1-(2,5-dimethylphenyl)-4-methyl-5-{2-[(propan-2-yl)sulfamoyl]-4-[(thiophene-2-carbonyl)amino]phenoxy}-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-(2,5-dimethylphenyl)-4-methyl-5-{2-[(propan-2-yl)sulfamoyl]-4-[(thiophene-2-carbonyl)amino]phenoxy}-1H-pyrazole-3-carboxylic acid
1-(2,5-dimethylphenyl)-4-methyl-5-{2-[(propan-2-yl)sulfamoyl]-4-[(thiophene-2-carbonyl)amino]phenoxy}-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V029-4543 |
| Compound Name: | 1-(2,5-dimethylphenyl)-4-methyl-5-{2-[(propan-2-yl)sulfamoyl]-4-[(thiophene-2-carbonyl)amino]phenoxy}-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 568.67 |
| Molecular Formula: | C27 H28 N4 O6 S2 |
| Salt: | not_available |
| Smiles: | CC(C)NS(c1cc(ccc1Oc1c(C)c(C(O)=O)nn1c1cc(C)ccc1C)NC(c1cccs1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0091 |
| logD: | 0.4931 |
| logSw: | -4.4921 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.635 |
| InChI Key: | QWHPURNKGSPTOO-UHFFFAOYSA-N |