5-[2-(tert-butylsulfamoyl)-4-(3,3-dimethylbutanamido)phenoxy]-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-[2-(tert-butylsulfamoyl)-4-(3,3-dimethylbutanamido)phenoxy]-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
5-[2-(tert-butylsulfamoyl)-4-(3,3-dimethylbutanamido)phenoxy]-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V029-9622 |
| Compound Name: | 5-[2-(tert-butylsulfamoyl)-4-(3,3-dimethylbutanamido)phenoxy]-1,4-dimethyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 480.58 |
| Molecular Formula: | C22 H32 N4 O6 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(O)=O)nn(C)c1Oc1ccc(cc1S(NC(C)(C)C)(=O)=O)NC(CC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7359 |
| logD: | 0.0229 |
| logSw: | -3.4064 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.246 |
| InChI Key: | BYXMMGBYOXFOBI-UHFFFAOYSA-N |