dimethyl 5-{2-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamido}-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{2-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamido}-3-methylthiophene-2,4-dicarboxylate
dimethyl 5-{2-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamido}-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | Y501-8059 |
| Compound Name: | dimethyl 5-{2-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamido}-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 445.42 |
| Molecular Formula: | C18 H18 F3 N3 O5 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(Cn2c(cc(C(F)(F)F)n2)C2CC2)=O)sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1716 |
| logD: | 1.0027 |
| logSw: | -3.3292 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.74 |
| InChI Key: | UVNNHDSXWFWKPA-UHFFFAOYSA-N |