5-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)sulfamoyl]-2-hydroxybenzoic acid
Chemical Structure Depiction of
5-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)sulfamoyl]-2-hydroxybenzoic acid
5-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)sulfamoyl]-2-hydroxybenzoic acid
Compound characteristics
Compound ID: | 7241-1829 |
Compound Name: | 5-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)sulfamoyl]-2-hydroxybenzoic acid |
Molecular Weight: | 403.41 |
Molecular Formula: | C18 H17 N3 O6 S |
Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NS(c1ccc(c(c1)C(O)=O)O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.6908 |
logD: | -3.941 |
logSw: | -2.6958 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 106.226 |
InChI Key: | XXZOTDHXSIGLDU-UHFFFAOYSA-N |