AC1MEJFV
6-(3-bromophenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: CBMicro_013873|ChemDiv1_002711|Oprea1_577035|Oprea1_830557|HMS594L05|BAS 01296197|BIM-0013963.P001|11-(3-bromophenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|SR-01000426108-1|6-(3-bromophenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one|10-(3-bromophenyl)-14-(4-methoxyphenyl)-2,9-diazatricyclo[9.4.0.0(3),?]pentadeca-1(11),3,5,7-tetraen-12-one|10-(3-bromophenyl)-14-(4-methoxyphenyl)-2,9-diazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7-tetraen-12-one|11-(3-BR-PH)-3-(4-MEO-PH)2,3,4,5,10,11-HEXAHYDRO-DIBENZO(B,E)(1,4)DIAZEPIN-1-ONE|11-(3-bromophenyl)-3-(4-methoxyphenyl)-2,3,4-trihydro-5H,10H,11H-benzo[b]benzo [2,1-f]1,4-diazepin-1-one
| Molecular Formula | C26H23BrN2O2 |
|---|---|
| Molecular Weight | 474.0943 g/mol |
| LogP | 6.4372 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 474.0943 |
| Monoisotopic Mass | 474.0943 |
| Heavy Atoms | 31 |
| Complexity | 1170.0343 |
Chemical Identifiers
| CAS Number | 5975-26-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=CC=C5)Br)C(=O)C2 |
Product Overview
AC1MEJFV (CAS 5975-26-8), with molecular formula C26H23BrN2O2 and molecular weight 474.0943 g/mol. IUPAC: 6-(3-bromophenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.