AC1MFB5X

6-(2,5-dimethylphenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one

Also Known As: CBMicro_047474|MixCom6_002418|Oprea1_251212|Oprea1_589923|BAS 02841736|BIM-0047606.P001|J2.677.144G|SR-01000455252-1|A2358/0099588|11-(2,5-dimethylphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|6-(2,5-dimethylphenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one|10-(2,5-dimethylphenyl)-14-(4-methoxyphenyl)-2,9-diazatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7-tetraen-12-one|11-(2,5-dimethylphenyl)-3-(4-methoxyphenyl)-2,3,4-trihydro-5H,10H,11H-benzo[b] benzo[2,1-f]1,4-diazepin-1-one|3-(4-Methoxyphenyl)-11-(2,5-dimethylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepine-1-one

Molecular Formula	C28H28N2O2
Molecular Weight	424.2151 g/mol
LogP	6.29154
Topological Polar Surface Area	50.36 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	3
Exact Mass	424.2151
Monoisotopic Mass	424.2151
Heavy Atoms	32
Complexity	1210.3569

Chemical Identifiers

CAS Number	297159-58-1
SMILES	CC1=CC(=C(C=C1)C)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)OC)NC5=CC=CC=C5N2