2-phenyl-N-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)butanamide
Chemical Structure Depiction of
2-phenyl-N-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)butanamide
2-phenyl-N-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)butanamide
Compound characteristics
| Compound ID: | V023-9554 |
| Compound Name: | 2-phenyl-N-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)butanamide |
| Molecular Weight: | 510.56 |
| Molecular Formula: | C28 H29 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | CCC(C(Nc1ccc(nc1)N1CCCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.679 |
| logD: | 5.6783 |
| logSw: | -5.3997 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.17 |
| InChI Key: | GMPUBSPFRMVTAF-XMMPIXPASA-N |