{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetic acid
Chemical Structure Depiction of
{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetic acid
{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetic acid
Compound characteristics
| Compound ID: | Y507-0074 |
| Compound Name: | {[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetic acid |
| Molecular Weight: | 346.33 |
| Molecular Formula: | C13 H13 F3 N4 O2 S |
| Smiles: | CCn1cc(c2cc(C(F)(F)F)nc(n2)SCC(O)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.943 |
| logD: | -1.501 |
| logSw: | -2.2639 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.499 |
| InChI Key: | SXCFUECQJVSHFA-UHFFFAOYSA-N |