3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)sulfamoyl]benzoic acid
Chemical Structure Depiction of
3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)sulfamoyl]benzoic acid
3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)sulfamoyl]benzoic acid
Compound characteristics
| Compound ID: | 3230-0689 |
| Compound Name: | 3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)sulfamoyl]benzoic acid |
| Molecular Weight: | 387.41 |
| Molecular Formula: | C18 H17 N3 O5 S |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NS(c1cccc(c1)C(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2878 |
| logD: | -3.709 |
| logSw: | -2.4002 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.677 |
| InChI Key: | MKGJOSJIXMSQOS-UHFFFAOYSA-N |