5-{4-(3,3-dimethylbutanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-ethyl-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-{4-(3,3-dimethylbutanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-ethyl-4-methyl-1H-pyrazole-3-carboxylic acid
5-{4-(3,3-dimethylbutanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-ethyl-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V004-9878 |
| Compound Name: | 5-{4-(3,3-dimethylbutanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-ethyl-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 480.58 |
| Molecular Formula: | C22 H32 N4 O6 S |
| Salt: | not_available |
| Smiles: | CCn1c(c(C)c(C(O)=O)n1)Oc1ccc(cc1S(NC(C)C)(=O)=O)NC(CC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0185 |
| logD: | 0.3055 |
| logSw: | -3.4105 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.835 |
| InChI Key: | OWRPZEOAOAUJEF-UHFFFAOYSA-N |