AC1MFBNR
9-(3,4-dimethoxyphenyl)-6-naphthalen-1-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: CBMicro_047546|ChemDiv1_006134|MixCom6_002490|Oprea1_246640|HMS604G18|BAS 04377791|BIM-0047652.P001|AG-205/15425351|SR-01000455241-1|3-(3,4-DIMETHOXYPHENYL)-11-(1-NAPHTHYL)-2,3,4,5,10,11-HEXAHYDRO-1H-DIBENZO[B,E][1,4]DIAZEPIN-1-ONE|3-(3,4-dimethoxyphenyl)-11-(naphthalen-1-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|9-(3,4-dimethoxyphenyl)-6-naphthalen-1-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one|3-(3,4-dimethoxyphenyl)-11-naphthyl-2,3,4-trihydro-5H,10H,11H-benzo[b]benzo[2, 1-f]1,4-diazepin-1-one|9-(3,4-dimethoxyphenyl)-6-(1-naphthyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C31H28N2O3 |
|---|---|
| Molecular Weight | 476.21 g/mol |
| LogP | 6.8365 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 476.21 |
| Monoisotopic Mass | 476.21 |
| Heavy Atoms | 36 |
| Complexity | 1501.7351 |
Chemical Identifiers
| CAS Number | 297159-50-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=CC6=CC=CC=C65)C(=O)C2)OC |
Product Overview
AC1MFBNR (CAS 297159-50-3), with molecular formula C31H28N2O3 and molecular weight 476.21 g/mol. IUPAC: 9-(3,4-dimethoxyphenyl)-6-naphthalen-1-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.