5-{2-[(butan-2-yl)sulfamoyl]-4-(2-methylbutanamido)phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-{2-[(butan-2-yl)sulfamoyl]-4-(2-methylbutanamido)phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
5-{2-[(butan-2-yl)sulfamoyl]-4-(2-methylbutanamido)phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V030-1752 |
| Compound Name: | 5-{2-[(butan-2-yl)sulfamoyl]-4-(2-methylbutanamido)phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 466.56 |
| Molecular Formula: | C21 H30 N4 O6 S |
| Salt: | not_available |
| Smiles: | CCC(C)C(Nc1ccc(c(c1)S(NC(C)CC)(=O)=O)Oc1c(C)c(C(O)=O)nn1C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4285 |
| logD: | -0.2845 |
| logSw: | -2.9637 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.077 |
| InChI Key: | JFURUEZMQLTHBC-UHFFFAOYSA-N |