N-(3-chloro-4-fluorophenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
N-(3-chloro-4-fluorophenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
Compound characteristics
| Compound ID: | F403-0054 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide |
| Molecular Weight: | 385.82 |
| Molecular Formula: | C20 H17 Cl F N3 O2 |
| Smiles: | C1CC2C(C1)=Nc1ccccc1N(CC(Nc1ccc(c(c1)[Cl])F)=O)C2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5697 |
| logD: | 3.554 |
| logSw: | -3.9651 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.513 |
| InChI Key: | HVLSUDMCDGKEHY-ZDUSSCGKSA-N |