4-{2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]acetamido}benzoic acid
Chemical Structure Depiction of
4-{2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]acetamido}benzoic acid
4-{2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]acetamido}benzoic acid
Compound characteristics
| Compound ID: | Y503-3774 |
| Compound Name: | 4-{2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]acetamido}benzoic acid |
| Molecular Weight: | 309.27 |
| Molecular Formula: | C14 H13 F2 N3 O3 |
| Smiles: | Cc1cc(C(F)F)nn1CC(Nc1ccc(cc1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7441 |
| logD: | -0.6511 |
| logSw: | -2.2878 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.725 |
| InChI Key: | DNSKFISWGVKAOH-UHFFFAOYSA-N |