ethyl 2-(butylamino)-4-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(butylamino)-4-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-1,3-thiazole-5-carboxylate
ethyl 2-(butylamino)-4-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | Y501-3260 |
| Compound Name: | ethyl 2-(butylamino)-4-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 458.52 |
| Molecular Formula: | C19 H21 F3 N4 O2 S2 |
| Smiles: | CCCCNc1nc(CSc2c(C#N)c(C)cc(C(F)(F)F)n2)c(C(=O)OCC)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.9716 |
| logD: | 5.9716 |
| logSw: | -5.4289 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.184 |
| InChI Key: | BIQVWAHKUAAGFC-UHFFFAOYSA-N |