5-[4-(3,3-dimethylbutanamido)-2-(propylsulfamoyl)phenoxy]-1-(4-methoxyphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-[4-(3,3-dimethylbutanamido)-2-(propylsulfamoyl)phenoxy]-1-(4-methoxyphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
5-[4-(3,3-dimethylbutanamido)-2-(propylsulfamoyl)phenoxy]-1-(4-methoxyphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V017-5124 |
| Compound Name: | 5-[4-(3,3-dimethylbutanamido)-2-(propylsulfamoyl)phenoxy]-1-(4-methoxyphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 558.65 |
| Molecular Formula: | C27 H34 N4 O7 S |
| Salt: | not_available |
| Smiles: | CCCNS(c1cc(ccc1Oc1c(C)c(C(O)=O)nn1c1ccc(cc1)OC)NC(CC(C)(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7464 |
| logD: | 0.2304 |
| logSw: | -4.5291 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 122.173 |
| InChI Key: | HVRROXJCRRVZQL-UHFFFAOYSA-N |