N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-(trifluoromethyl)benzamide
N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V011-6806 |
| Compound Name: | N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-(trifluoromethyl)benzamide |
| Molecular Weight: | 537.37 |
| Molecular Formula: | C25 H21 Cl2 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(c1ccccc1C(F)(F)F)=O)C(c1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4463 |
| logD: | 5.1896 |
| logSw: | -5.9854 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.17 |
| InChI Key: | AFWZIZBGVLJXCZ-UHFFFAOYSA-N |