AC1N6G42

9-(3,4-dimethoxyphenyl)-5-(2-methylpropanoyl)-6-thiophen-2-yl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

Also Known As: 3-(3,4-dimethoxyphenyl)-10-isobutyryl-11-(2-thienyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|AJ-292/41694799|3-(3,4-dimethoxyphenyl)-10-(2-methylpropanoyl)-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|9-(3,4-dimethoxyphenyl)-5-(2-methylpropanoyl)-6-thiophen-2-yl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one|1-[3-(3,4-dimethoxyphenyl)-1-hydroxy-11-(thiophen-2-yl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2-methylpropan-1-one|3-(3,4-dimethoxyphenyl)-10-(2-methylpropanoyl)-11-(2-thienyl)-2,3,4-trihydro-5 H,11H-benzo[b]benzo[2,1-f]1,4-diazepin-1-one|3-(3,4-dimethoxyphenyl)-10-isobutyryl-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Molecular Formula	C29H30N2O4S
Molecular Weight	502.19263 g/mol
LogP	6.3219
Topological Polar Surface Area	67.87 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	502.19263
Monoisotopic Mass	502.19263
Heavy Atoms	36
Complexity	1328.802

Chemical Identifiers

CAS Number	523992-76-9
SMILES	CC(C)C(=O)N1C(C2=C(CC(CC2=O)C3=CC(=C(C=C3)OC)OC)NC4=CC=CC=C41)C5=CC=CS5