2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | F403-0041 |
| Compound Name: | 2-(10-oxo-2,3,10,10a-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-9(1H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 401.39 |
| Molecular Formula: | C21 H18 F3 N3 O2 |
| Smiles: | C1CC2C(C1)=Nc1ccccc1N(CC(Nc1cccc(c1)C(F)(F)F)=O)C2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8828 |
| logD: | 3.8819 |
| logSw: | -4.1894 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.513 |
| InChI Key: | QMFZHYFWSHSURF-HNNXBMFYSA-N |