RefChem:1065058

bis((Z)-but-2-enedioic acid);7-chloro-5-phenyl-1-(2-piperazin-1-ylethyl)-3H-1,4-benzodiazepin-2-one

Also Known As: 7-Chloro-1,3-dihydro-5-phenyl-1-(2-(1-piperazinyl)ethyl)-2H-1,4-benzodiazepin-2-one dimaleate|2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-5-phenyl-1-(2-(1-piperazinyl)ethyl)-, maleate (1:2)|2H-1,4-BENZODIAZEPIN-2-ONE, 1,3-DIHYDRO-7-CHLORO-5-PHENYL-1-(2-(1-PIPERAZINYL)ET|(Z)-but-2-enedioic acid; 7-chloro-5-phenyl-1-(2-piperazin-1-ylethyl)-3H-1,4-benzodiazepin-2-one|2H-1,4-Benzodiazepin-2-one, 7-chloro-1,3-dihydro-5-phenyl-1-[2-(1-piperazinyl)ethyl]-, maleate (1:2)

Molecular Formula	C29H31ClN4O9
Molecular Weight	614.178 g/mol
LogP	1.8528
Topological Polar Surface Area	197.14 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	614.178
Monoisotopic Mass	614.178
Heavy Atoms	43
Complexity	1321.5807

Chemical Identifiers

CAS Number	4130-65-8
SMILES	C1NCCN(C1)CCN2C3=C(C(=NCC2=O)C4=CC=CC=C4)C=C(C=C3)Cl.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O