5-[2-(cyclopropylsulfamoyl)-4-(2-ethylbutanamido)phenoxy]-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-[2-(cyclopropylsulfamoyl)-4-(2-ethylbutanamido)phenoxy]-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
5-[2-(cyclopropylsulfamoyl)-4-(2-ethylbutanamido)phenoxy]-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V027-4013 |
| Compound Name: | 5-[2-(cyclopropylsulfamoyl)-4-(2-ethylbutanamido)phenoxy]-1,4-dimethyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 464.54 |
| Molecular Formula: | C21 H28 N4 O6 S |
| Salt: | not_available |
| Smiles: | CCC(CC)C(Nc1ccc(c(c1)S(NC1CC1)(=O)=O)Oc1c(C)c(C(O)=O)nn1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0057 |
| logD: | -0.7073 |
| logSw: | -2.9008 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.421 |
| InChI Key: | SPKKFMIOCIPYFV-UHFFFAOYSA-N |