1-methyl-N-[2-(methylsulfanyl)phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-N-[2-(methylsulfanyl)phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
1-methyl-N-[2-(methylsulfanyl)phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D522-0177 |
| Compound Name: | 1-methyl-N-[2-(methylsulfanyl)phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 315.31 |
| Molecular Formula: | C13 H12 F3 N3 O S |
| Smiles: | [H]c1c(C(Nc2ccccc2SC)=O)nn(C)c1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 2.6898 |
| logD: | 2.6898 |
| logSw: | -3.3014 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.148 |
| InChI Key: | HKRHIGGFSRYYAX-UHFFFAOYSA-N |