1-tert-butyl-4-methyl-5-{4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-tert-butyl-4-methyl-5-{4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1H-pyrazole-3-carboxylic acid
1-tert-butyl-4-methyl-5-{4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V029-4999 |
| Compound Name: | 1-tert-butyl-4-methyl-5-{4-(2-methylpropanamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 480.58 |
| Molecular Formula: | C22 H32 N4 O6 S |
| Salt: | not_available |
| Smiles: | CC(C)C(Nc1ccc(c(c1)S(NC(C)C)(=O)=O)Oc1c(C)c(C(O)=O)nn1C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9256 |
| logD: | 0.2126 |
| logSw: | -3.4429 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.156 |
| InChI Key: | IDKSBBVAUCHWBG-UHFFFAOYSA-N |