AC1N2L6B
5-benzoyl-6-(3-fluorophenyl)-9-(4-methoxyphenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: [11-(3-fluorophenyl)-1-hydroxy-3-(4-methoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl](phenyl)methanone|10-benzoyl-11-(3-fluorophenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|11-(3-fluorophenyl)-3-(4-methoxyphenyl)-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|5-benzoyl-6-(3-fluorophenyl)-9-(4-methoxyphenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C33H27FN2O3 |
|---|---|
| Molecular Weight | 518.20056 g/mol |
| LogP | 7.0487 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 518.20056 |
| Monoisotopic Mass | 518.20056 |
| Heavy Atoms | 39 |
| Complexity | 1580.3397 |
Chemical Identifiers
| CAS Number | 489441-77-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)C5=CC=CC=C5)C6=CC(=CC=C6)F)C(=O)C2 |
Product Overview
AC1N2L6B (CAS 489441-77-2), with molecular formula C33H27FN2O3 and molecular weight 518.20056 g/mol. IUPAC: 5-benzoyl-6-(3-fluorophenyl)-9-(4-methoxyphenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one.