5-{4-(4-fluoro-3-methylbenzamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-4-methyl-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-{4-(4-fluoro-3-methylbenzamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-4-methyl-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid
5-{4-(4-fluoro-3-methylbenzamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-4-methyl-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V027-2211 |
| Compound Name: | 5-{4-(4-fluoro-3-methylbenzamido)-2-[(propan-2-yl)sulfamoyl]phenoxy}-4-methyl-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 580.64 |
| Molecular Formula: | C29 H29 F N4 O6 S |
| Salt: | not_available |
| Smiles: | CC(C)NS(c1cc(ccc1Oc1c(C)c(C(O)=O)nn1c1ccc(C)cc1)NC(c1ccc(c(C)c1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0176 |
| logD: | 0.5016 |
| logSw: | -4.517 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.917 |
| InChI Key: | VADDLZSVENLULR-UHFFFAOYSA-N |