4-methyl-5-{4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-(propan-2-yl)-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-methyl-5-{4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-(propan-2-yl)-1H-pyrazole-3-carboxylic acid
4-methyl-5-{4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-(propan-2-yl)-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V005-5142 |
| Compound Name: | 4-methyl-5-{4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-(propan-2-yl)-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 466.56 |
| Molecular Formula: | C21 H30 N4 O6 S |
| Smiles: | CC(C)C(Nc1ccc(c(c1)S(NC(C)C)(=O)=O)Oc1c(C)c(C(O)=O)nn1C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7203 |
| logD: | 0.0073 |
| logSw: | -3.3814 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.792 |
| InChI Key: | JFXRRLDBCKRFOC-UHFFFAOYSA-N |