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Piperazines

Organic heterocyclic compounds that consist of a six-membered ring with four carbon atoms and two nitrogen atoms at opposite positions in the ring.

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1

Terazosin hydrochloride dihydrate, 98%, Thermo Scientific Chemicals

CAS: 70024-40-7 Molecular Formula: ClH·2H2O Molecular Weight (g/mol): 459.92 InChI Key: NZMOFYDMGFQZLS-UHFFFAOYSA-N Synonym: terazosin hydrochloride dihydrate,magnurol,dysalfa,flotrin,heitrin,hytrine,adecur,deflox,urodie,hytrin PubChem CID: 63016 ChEBI: CHEBI:9446 IUPAC Name: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone;dihydrate;hydrochloride SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4CCCO4)N)OC.O.O.Cl

PubChem CID 63016
CAS 70024-40-7
Molecular Weight (g/mol) 459.92
ChEBI CHEBI:9446
SMILES COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4CCCO4)N)OC.O.O.Cl
Synonym terazosin hydrochloride dihydrate,magnurol,dysalfa,flotrin,heitrin,hytrine,adecur,deflox,urodie,hytrin
IUPAC Name [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone;dihydrate;hydrochloride
InChI Key NZMOFYDMGFQZLS-UHFFFAOYSA-N
Molecular Formula ClH·2H2O
2
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Thermo Scientific Chemicals Ketoconazole, 98%

CAS: 65277-42-1 Molecular Formula: C26H28Cl2N4O4 Molecular Weight (g/mol): 531.44 InChI Key: XMAYWYJOQHXEEK-SIULDFEJSA-N Synonym: ketoconazole PubChem CID: 76973198 IUPAC Name: 2,2,2-trideuterio-1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone SMILES: CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl

PubChem CID 76973198
CAS 65277-42-1
Molecular Weight (g/mol) 531.44
SMILES CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl
Synonym ketoconazole
IUPAC Name 2,2,2-trideuterio-1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone
InChI Key XMAYWYJOQHXEEK-SIULDFEJSA-N
Molecular Formula C26H28Cl2N4O4
3

1-(4-Nitrophenyl)piperazine, 98%

CAS: 6269-89-2 Molecular Formula: C10H13N3O2 Molecular Weight (g/mol): 207.23 MDL Number: MFCD00005961 InChI Key: VWOJSRICSKDKAW-UHFFFAOYSA-N Synonym: 1-4-nitrophenyl piperazine,1-4-nitro-phenyl-piperazine,piperazine, 1-4-nitrophenyl,1-4-nitrophenyl-piperazine,n-4-nitrophenyl piperazine,n-4-nitrophenyl-piperazine,4-nitrophenyl piperazine,1-4-nitrophenyl piperazin,pubchem8580,4-nitrophenylpiperazine PubChem CID: 80447 SMILES: C1CN(CCN1)C2=CC=C(C=C2)[N+](=O)[O-]

PubChem CID 80447
CAS 6269-89-2
Molecular Weight (g/mol) 207.23
MDL Number MFCD00005961
SMILES C1CN(CCN1)C2=CC=C(C=C2)[N+](=O)[O-]
Synonym 1-4-nitrophenyl piperazine,1-4-nitro-phenyl-piperazine,piperazine, 1-4-nitrophenyl,1-4-nitrophenyl-piperazine,n-4-nitrophenyl piperazine,n-4-nitrophenyl-piperazine,4-nitrophenyl piperazine,1-4-nitrophenyl piperazin,pubchem8580,4-nitrophenylpiperazine
InChI Key VWOJSRICSKDKAW-UHFFFAOYSA-N
Molecular Formula C10H13N3O2
4
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Thermo Scientific Chemicals Itraconazole, 99%

CAS: 84625-61-6 Molecular Formula: C35H38Cl2N8O4 Molecular Weight (g/mol): 705.64 MDL Number: MFCD00870168,MFCD00941396 InChI Key: VHVPQPYKVGDNFY-ZPGVKDDISA-N Synonym: itraconazole-d5,itraconazole,oriconazole-d5,triasporin-d5,sporamelt-d5,itrizole-d5,sporanox-d5,+/--4-4-4-4-2r,4s-2,4-dichlorophenyl-2-1h-1,2,4-triazol-1-ylmethyl-1,3-dioxolan-4-yl methoxy phenyl-1-piperazinyl phenyl-2,4-dihydro-2-1-methylpropyl-d5-3h-1,2,4-triazol-3-one,2h5-4-4-4-4-2-1h-1,2,4-triazol-1-yl methyl-2-2,4-dichlorophenyl-1,3-dioxolan-4-yl methoxy phenyl piperazin-1-yl phenyl-1-sec-butyl-1h-1,2,4-triazol-5 4h-one,2-3,3,4,4,4-2 h? butan-2-yl-4-4-4-4-2r,4s-2-2,4-dichlorophenyl-2-1,2,4-triazol-1-ylmethyl-1,3-dioxolan-4-yl methoxy phenyl piperazin-1-yl phenyl-1,2,4-triazol-3-one PubChem CID: 45039617 IUPAC Name: 4-[4-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(3,3,4,4,4-pentadeuteriobutan-2-yl)-1,2,4-triazol-3-one SMILES: CCC(C)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=NC=N3)(O2)C2=CC=C(Cl)C=C2Cl)C=C1

PubChem CID 45039617
CAS 84625-61-6
Molecular Weight (g/mol) 705.64
MDL Number MFCD00870168,MFCD00941396
SMILES CCC(C)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=NC=N3)(O2)C2=CC=C(Cl)C=C2Cl)C=C1
Synonym itraconazole-d5,itraconazole,oriconazole-d5,triasporin-d5,sporamelt-d5,itrizole-d5,sporanox-d5,+/--4-4-4-4-2r,4s-2,4-dichlorophenyl-2-1h-1,2,4-triazol-1-ylmethyl-1,3-dioxolan-4-yl methoxy phenyl-1-piperazinyl phenyl-2,4-dihydro-2-1-methylpropyl-d5-3h-1,2,4-triazol-3-one,2h5-4-4-4-4-2-1h-1,2,4-triazol-1-yl methyl-2-2,4-dichlorophenyl-1,3-dioxolan-4-yl methoxy phenyl piperazin-1-yl phenyl-1-sec-butyl-1h-1,2,4-triazol-5 4h-one,2-3,3,4,4,4-2 h? butan-2-yl-4-4-4-4-2r,4s-2-2,4-dichlorophenyl-2-1,2,4-triazol-1-ylmethyl-1,3-dioxolan-4-yl methoxy phenyl piperazin-1-yl phenyl-1,2,4-triazol-3-one
IUPAC Name 4-[4-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(3,3,4,4,4-pentadeuteriobutan-2-yl)-1,2,4-triazol-3-one
InChI Key VHVPQPYKVGDNFY-ZPGVKDDISA-N
Molecular Formula C35H38Cl2N8O4
5

1,3-Bis[4-(7-chloro-4-quinolinyl)-1-piperazinyl]propane tetraphosphate tetrahydrate, 98%, Thermo Scientific™

CAS: 915967-82-7 Molecular Formula: C29H52Cl2N6O20P4 Molecular Weight (g/mol): 999.552 MDL Number: MFCD11870901 InChI Key: AMCQDGFOKTXHSY-UHFFFAOYSA-N Synonym: piperaquine phosphate hydrate,piperaquine tetraphosphate tetrahydrate,unii-854d7k8lxb,piperaquine tetraphosphate hydrate,piperaquine phosphate,quinoline, 4,4'-1,3-propanediyldi-4,1-piperazinediyl bis 7-chloro-, phosphate, hydrate 1:4:4,piperaquine tetraphosphate tetrahydrate hplc,tetrakis phosphoric acid piperaquine tetrahydrate,1,3-bis 4-7-chloroquinolin-4-yl piperazin-1-yl propane tetrakis phosphate tetrahydrate PubChem CID: 49849842 IUPAC Name: 7-chloro-4-[4-[3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]propyl]piperazin-1-yl]quinoline;phosphoric acid;tetrahydrate SMILES: C1CN(CCN1CCCN2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl)C5=C6C=CC(=CC6=NC=C5)Cl.O.O.O.O.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

PubChem CID 49849842
CAS 915967-82-7
Molecular Weight (g/mol) 999.552
MDL Number MFCD11870901
SMILES C1CN(CCN1CCCN2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl)C5=C6C=CC(=CC6=NC=C5)Cl.O.O.O.O.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O
Synonym piperaquine phosphate hydrate,piperaquine tetraphosphate tetrahydrate,unii-854d7k8lxb,piperaquine tetraphosphate hydrate,piperaquine phosphate,quinoline, 4,4'-1,3-propanediyldi-4,1-piperazinediyl bis 7-chloro-, phosphate, hydrate 1:4:4,piperaquine tetraphosphate tetrahydrate hplc,tetrakis phosphoric acid piperaquine tetrahydrate,1,3-bis 4-7-chloroquinolin-4-yl piperazin-1-yl propane tetrakis phosphate tetrahydrate
IUPAC Name 7-chloro-4-[4-[3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]propyl]piperazin-1-yl]quinoline;phosphoric acid;tetrahydrate
InChI Key AMCQDGFOKTXHSY-UHFFFAOYSA-N
Molecular Formula C29H52Cl2N6O20P4
6

JNJ 1661010, Tocris Bioscience™

CAS: 681136-29-8 Molecular Formula: C19H19N5OS Molecular Weight (g/mol): 365.46 MDL Number: MFCD00209157 InChI Key: BHBOSTKQCZEAJM-UHFFFAOYSA-N Synonym: n-phenyl-4-3-phenyl-1,2,4-thiadiazol-5-yl piperazine-1-carboxamide,1-piperazinecarboxamide, n-phenyl-4-3-phenyl-1,2,4-thiadiazol-5-yl,n-phenyl-4-3-phenyl-1,2,4-thiadiazol-5-yl-1-piperazinecarboxamide,acmc-20emff,d0w5wg,jnj hplc,n1-phenyl-4-3-phenyl-1,2,4-thiadiazol-5-yl piperazine-1-carboxamide PubChem CID: 2809273 IUPAC Name: N-phenyl-4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carboxamide SMILES: O=C(NC1=CC=CC=C1)N1CCN(CC1)C1=NC(=NS1)C1=CC=CC=C1

PubChem CID 2809273
CAS 681136-29-8
Molecular Weight (g/mol) 365.46
MDL Number MFCD00209157
SMILES O=C(NC1=CC=CC=C1)N1CCN(CC1)C1=NC(=NS1)C1=CC=CC=C1
Synonym n-phenyl-4-3-phenyl-1,2,4-thiadiazol-5-yl piperazine-1-carboxamide,1-piperazinecarboxamide, n-phenyl-4-3-phenyl-1,2,4-thiadiazol-5-yl,n-phenyl-4-3-phenyl-1,2,4-thiadiazol-5-yl-1-piperazinecarboxamide,acmc-20emff,d0w5wg,jnj hplc,n1-phenyl-4-3-phenyl-1,2,4-thiadiazol-5-yl piperazine-1-carboxamide
IUPAC Name N-phenyl-4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carboxamide
InChI Key BHBOSTKQCZEAJM-UHFFFAOYSA-N
Molecular Formula C19H19N5OS