methyl 4-({2-methyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-3-sulfonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({2-methyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-3-sulfonyl}amino)benzoate
methyl 4-({2-methyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-3-sulfonyl}amino)benzoate
Compound characteristics
| Compound ID: | M089-0205 |
| Compound Name: | methyl 4-({2-methyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-3-sulfonyl}amino)benzoate |
| Molecular Weight: | 445.44 |
| Molecular Formula: | C17 H14 F3 N3 O4 S2 |
| Smiles: | Cc1c(cc(c2cc(C(F)(F)F)[nH]n2)s1)S(Nc1ccc(cc1)C(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5386 |
| logD: | 4.258 |
| logSw: | -4.354 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.57 |
| InChI Key: | HPDQIPDWTNQSHR-UHFFFAOYSA-N |