N-(2-chloro-4-methylphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
N-(2-chloro-4-methylphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
Compound characteristics
| Compound ID: | F403-0048 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide |
| Molecular Weight: | 381.86 |
| Molecular Formula: | C21 H20 Cl N3 O2 |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CN1C(C2CCCC2=Nc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5633 |
| logD: | 3.563 |
| logSw: | -3.7715 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.815 |
| InChI Key: | BRODXIMQVYWQDA-AWEZNQCLSA-N |