10-acetyl-3-(4-fluorophenyl)-11-(pyridin-3-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-acetyl-3-(4-fluorophenyl)-11-(pyridin-3-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-acetyl-3-(4-fluorophenyl)-11-(pyridin-3-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 8013-0861 |
| Compound Name: | 10-acetyl-3-(4-fluorophenyl)-11-(pyridin-3-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C26 H22 F N3 O2 |
| Smiles: | CC(N1C(C2=C(CC(CC2=O)c2ccc(cc2)F)Nc2ccccc12)c1cccnc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0821 |
| logD: | 3.8205 |
| logSw: | -3.9644 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.15 |
| InChI Key: | NSTOXWAGNZTKNY-UHFFFAOYSA-N |