N-[4-(methanesulfonyl)phenyl]-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
Chemical Structure Depiction of
N-[4-(methanesulfonyl)phenyl]-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
N-[4-(methanesulfonyl)phenyl]-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide
Compound characteristics
| Compound ID: | F403-0444 |
| Compound Name: | N-[4-(methanesulfonyl)phenyl]-2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)acetamide |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C21 H21 N3 O4 S |
| Smiles: | CS(c1ccc(cc1)NC(CN1C(C2CCCC2=Nc2ccccc12)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6564 |
| logD: | 1.6561 |
| logSw: | -2.5523 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.262 |
| InChI Key: | IHOCJTZHWXGRCV-INIZCTEOSA-N |