N-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)thiophene-2-carboxamide
N-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V010-6496 |
| Compound Name: | N-(6-{4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}pyridin-3-yl)thiophene-2-carboxamide |
| Molecular Weight: | 474.5 |
| Molecular Formula: | C23 H21 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(c1cccs1)=O)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7245 |
| logD: | 4.7242 |
| logSw: | -4.6165 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.189 |
| InChI Key: | AMNWUTYLNHGCLN-UHFFFAOYSA-N |