Cep-9722
14-methoxy-9-[(4-methylpiperazin-1-yl)methyl]-9,19-diazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),2(6),7(11),13(18),14,16-hexaene-8,10-dione
Molecular Identity
Cep-9722
14-methoxy-9-[(4-methylpiperazin-1-yl)methyl]-9,19-diazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),2(6),7(11),13(18),14,16-hexaene-8,10-dione
PubChem CID: 24780387
2D Structure
Properties
C24H26N4O3
Molecular Formula
418.50
Molecular Weight
g/mol
418.2005
Exact Mass
Da
3.1
XLogP
Drug-like (Lipinski: < 5)
68.9
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
738
Complexity
SMILES
Canonical SMILES
SMILES: CN1CCN(CC1)CN2C(=O)C3=C(C2=O)C4=C(C5=C3CCC5)NC6=C4C(=CC=C6)OCIsomeric SMILES
SMILES: CN1CCN(CC1)CN2C(=O)C3=C(C2=O)C4=C(C5=C3CCC5)NC6=C4C(=CC=C6)OCSynonyms(20)
CEP-9722916574-83-9B68083E4YG1H-Cyclopenta(a)pyrrolo(3,4-C)carbazole-1,3(2H)-dione, 4,5,6,7-tetrahydro-11-methoxy-2-((4-methyl-1-piperazinyl)methyl)-4,5,6,7-Tetrahydro-11-methoxy-2-((4-methyl-1-piperazinyl)methyl)-1H-cyclopenta(a)pyrrolo(3,4-C)carbazole-1,3(2H)-dioneRefChem:124354PARP Inhibitor CEP-972214-methoxy-9-((4-methylpiperazin-1-yl)methyl)-9,19-diazapentacyclo(10.7.0.0^(2,6).0^(7,11).0^(13,18))nonadeca-1(12),2(6),7(11),13(18),14,16-hexaene-8,10-dioneUNII-B68083E4YGCEP 9722 [WHO-DD]CEP 972211-methoxy-2-((4-methylpiperazin-1-yl)methyl)-4,5,6,7-tetrahydro-1H-cyclopenta[a]pyrrolo[3,4-c]carbazole-1,3(2H)-dione14-methoxy-9-[(4-methylpiperazin-1-yl)methyl]-9,19-diazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),2(6),7(11),13(18),14,16-hexaene-8,10-dioneorb1687843SCHEMBL3359996
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Cep-9722
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