2-phenyl-N-[6-(4-{[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl)pyridin-3-yl]butanamide
Chemical Structure Depiction of
2-phenyl-N-[6-(4-{[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl)pyridin-3-yl]butanamide
2-phenyl-N-[6-(4-{[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl)pyridin-3-yl]butanamide
Compound characteristics
| Compound ID: | V021-5604 |
| Compound Name: | 2-phenyl-N-[6-(4-{[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl)pyridin-3-yl]butanamide |
| Molecular Weight: | 496.58 |
| Molecular Formula: | C28 H31 F3 N4 O |
| Salt: | not_available |
| Smiles: | CCC(C(Nc1ccc(nc1)N1CCCN(CC1)Cc1ccc(cc1)C(F)(F)F)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.21 |
| logD: | 5.7524 |
| logSw: | -5.4586 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.255 |
| InChI Key: | PXDKCAMAIWCDHX-RUZDIDTESA-N |