4-{4-[(cyclopentanecarbonyl)amino]-2-(diethylcarbamoyl)phenyl}-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-{4-[(cyclopentanecarbonyl)amino]-2-(diethylcarbamoyl)phenyl}-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide
4-{4-[(cyclopentanecarbonyl)amino]-2-(diethylcarbamoyl)phenyl}-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V013-9091 |
| Compound Name: | 4-{4-[(cyclopentanecarbonyl)amino]-2-(diethylcarbamoyl)phenyl}-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 573.66 |
| Molecular Formula: | C30 H38 F3 N5 O3 |
| Salt: | not_available |
| Smiles: | CCN(CC)C(c1cc(ccc1N1CCCN(CC1)C(Nc1cccc(c1)C(F)(F)F)=O)NC(C1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2626 |
| logD: | 5.2586 |
| logSw: | -5.1656 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.579 |
| InChI Key: | HMZYXCXWRAYPRE-UHFFFAOYSA-N |