5-{2-(tert-butylsulfamoyl)-4-[(cyclopropanecarbonyl)amino]phenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-{2-(tert-butylsulfamoyl)-4-[(cyclopropanecarbonyl)amino]phenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
5-{2-(tert-butylsulfamoyl)-4-[(cyclopropanecarbonyl)amino]phenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V027-6124 |
| Compound Name: | 5-{2-(tert-butylsulfamoyl)-4-[(cyclopropanecarbonyl)amino]phenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 540.64 |
| Molecular Formula: | C27 H32 N4 O6 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1C)n1c(c(C)c(C(O)=O)n1)Oc1ccc(cc1S(NC(C)(C)C)(=O)=O)NC(C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4717 |
| logD: | -0.0443 |
| logSw: | -4.3067 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.989 |
| InChI Key: | CBRGIQSVOCVMMD-UHFFFAOYSA-N |