N-(1,3-benzothiazol-2-yl)-2-{[3-cyano-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-2-{[3-cyano-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
N-(1,3-benzothiazol-2-yl)-2-{[3-cyano-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8001-5677 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-2-{[3-cyano-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 476.52 |
| Molecular Formula: | C20 H11 F3 N4 O S3 |
| Smiles: | C(C(Nc1nc2ccccc2s1)=O)Sc1c(C#N)c(cc(c2cccs2)n1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.2091 |
| logD: | 6.209 |
| logSw: | -5.9339 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.428 |
| InChI Key: | JOPACRFXZYQFHD-UHFFFAOYSA-N |