4-methyl-1-(4-methylphenyl)-5-[4-(2-methylpropanamido)-2-(propylsulfamoyl)phenoxy]-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-methyl-1-(4-methylphenyl)-5-[4-(2-methylpropanamido)-2-(propylsulfamoyl)phenoxy]-1H-pyrazole-3-carboxylic acid
4-methyl-1-(4-methylphenyl)-5-[4-(2-methylpropanamido)-2-(propylsulfamoyl)phenoxy]-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V029-5046 |
| Compound Name: | 4-methyl-1-(4-methylphenyl)-5-[4-(2-methylpropanamido)-2-(propylsulfamoyl)phenoxy]-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 514.6 |
| Molecular Formula: | C25 H30 N4 O6 S |
| Salt: | not_available |
| Smiles: | CCCNS(c1cc(ccc1Oc1c(C)c(C(O)=O)nn1c1ccc(C)cc1)NC(C(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2956 |
| logD: | -0.2204 |
| logSw: | -4.1631 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.843 |
| InChI Key: | NKYBABYZCLIJKW-UHFFFAOYSA-N |