3,5-difluoro-N-[6-(4-{[2-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl)pyridin-3-yl]benzamide
Chemical Structure Depiction of
3,5-difluoro-N-[6-(4-{[2-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl)pyridin-3-yl]benzamide
3,5-difluoro-N-[6-(4-{[2-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl)pyridin-3-yl]benzamide
Compound characteristics
| Compound ID: | V021-9101 |
| Compound Name: | 3,5-difluoro-N-[6-(4-{[2-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl)pyridin-3-yl]benzamide |
| Molecular Weight: | 490.48 |
| Molecular Formula: | C25 H23 F5 N4 O |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(c1cc(cc(c1)F)F)=O)Cc1ccccc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.9412 |
| logD: | 5.9023 |
| logSw: | -5.7553 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.255 |
| InChI Key: | KMEOBDRKKQHQSY-UHFFFAOYSA-N |