2-{[3-cyano-4-(1,5-dimethyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(prop-2-en-1-yl)acetamide
Chemical Structure Depiction of
2-{[3-cyano-4-(1,5-dimethyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(prop-2-en-1-yl)acetamide
2-{[3-cyano-4-(1,5-dimethyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(prop-2-en-1-yl)acetamide
Compound characteristics
| Compound ID: | Y503-1442 |
| Compound Name: | 2-{[3-cyano-4-(1,5-dimethyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(prop-2-en-1-yl)acetamide |
| Molecular Weight: | 395.4 |
| Molecular Formula: | C17 H16 F3 N5 O S |
| Smiles: | Cc1c(cnn1C)c1cc(C(F)(F)F)nc(c1C#N)SCC(NCC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.405 |
| logD: | 2.405 |
| logSw: | -2.7153 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.57 |
| InChI Key: | YNHYDXAZHHXYOZ-UHFFFAOYSA-N |