3,5-difluoro-N-{6-[4-(thiophene-2-carbonyl)-1,4-diazepan-1-yl]pyridin-3-yl}benzamide
Chemical Structure Depiction of
3,5-difluoro-N-{6-[4-(thiophene-2-carbonyl)-1,4-diazepan-1-yl]pyridin-3-yl}benzamide
3,5-difluoro-N-{6-[4-(thiophene-2-carbonyl)-1,4-diazepan-1-yl]pyridin-3-yl}benzamide
Compound characteristics
| Compound ID: | V012-6705 |
| Compound Name: | 3,5-difluoro-N-{6-[4-(thiophene-2-carbonyl)-1,4-diazepan-1-yl]pyridin-3-yl}benzamide |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C22 H20 F2 N4 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(c1cc(cc(c1)F)F)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6115 |
| logD: | 4.5952 |
| logSw: | -4.249 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.189 |
| InChI Key: | YPYKSRUHGWLWFO-UHFFFAOYSA-N |