N-(4-chloro-2-methoxy-5-methylphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
Chemical Structure Depiction of
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
Compound characteristics
| Compound ID: | F403-0088 |
| Compound Name: | N-(4-chloro-2-methoxy-5-methylphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide |
| Molecular Weight: | 411.89 |
| Molecular Formula: | C22 H22 Cl N3 O3 |
| Smiles: | Cc1cc(c(cc1[Cl])OC)NC(CN1C(C2CCCC2=Nc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7905 |
| logD: | 3.7866 |
| logSw: | -4.2189 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.445 |
| InChI Key: | HKVFNGRIPLPIDW-AWEZNQCLSA-N |