4-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanamido]benzoic acid
Chemical Structure Depiction of
4-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanamido]benzoic acid
4-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanamido]benzoic acid
Compound characteristics
| Compound ID: | Y502-9651 |
| Compound Name: | 4-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanamido]benzoic acid |
| Molecular Weight: | 335.79 |
| Molecular Formula: | C16 H18 Cl N3 O3 |
| Smiles: | CC(Cn1c(C)c(c(C)n1)[Cl])C(Nc1ccc(cc1)C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5046 |
| logD: | 0.1094 |
| logSw: | -3.3843 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.291 |
| InChI Key: | IDWVYSIHDAYLIQ-VIFPVBQESA-N |