AC1MXWVC

6-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

Also Known As: 11-(3-methoxy-4-((4-nitrobenzyl)oxy)phenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|11-{3-methoxy-4-[(4-nitrobenzyl)oxy]phenyl}-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|6-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

Molecular Formula	C31H33N3O5
Molecular Weight	527.242 g/mol
LogP	7.02114
Topological Polar Surface Area	102.73 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	6
Exact Mass	527.242
Monoisotopic Mass	527.242
Heavy Atoms	39
Complexity	1490.8043

Chemical Identifiers

CAS Number	836638-99-4
SMILES	CC1=CC2=C(C=C1C)NC3=C(C(N2)C4=CC(=C(C=C4)OCC5=CC=C(C=C5)[N+](=O)[O-])OC)C(=O)CC(C3)(C)C