N-(6-{4-[(furan-2-yl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-(6-{4-[(furan-2-yl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-4-(trifluoromethyl)benzamide
N-(6-{4-[(furan-2-yl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V017-1439 |
| Compound Name: | N-(6-{4-[(furan-2-yl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 444.46 |
| Molecular Formula: | C23 H23 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(c1ccc(cc1)C(F)(F)F)=O)Cc1ccco1 |
| Stereo: | ACHIRAL |
| logP: | 4.7503 |
| logD: | 4.683 |
| logSw: | -4.5739 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.003 |
| InChI Key: | URTXMKKCCVBXQM-UHFFFAOYSA-N |