N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-[(3,5-dimethylphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-[(3,5-dimethylphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-[(3,5-dimethylphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
Compound ID: | K788-4230 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-[(3,5-dimethylphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide |
Molecular Weight: | 505.55 |
Molecular Formula: | C26 H23 N3 O6 S |
Smiles: | Cc1cc(C)cc(c1)NS(c1ccc2c(c1)C(C(=CN2)C(NCc1ccc2c(c1)OCO2)=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.5948 |
logD: | 2.7617 |
logSw: | -3.9124 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 106.536 |
InChI Key: | PNYOVXCXTWATHP-UHFFFAOYSA-N |