4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanoic acid
Chemical Structure Depiction of
4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanoic acid
4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanoic acid
Compound characteristics
| Compound ID: | Y503-2311 |
| Compound Name: | 4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanoic acid |
| Molecular Weight: | 404.36 |
| Molecular Formula: | C16 H15 F3 N2 O5 S |
| Smiles: | COc1ccccc1c1cc(C(F)(F)F)nc(n1)S(CCCC(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0289 |
| logD: | -0.7993 |
| logSw: | -2.681 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.138 |
| InChI Key: | CRTONYYTUQIFLW-UHFFFAOYSA-N |