4-[(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)sulfamoyl]benzoic acid
Chemical Structure Depiction of
4-[(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)sulfamoyl]benzoic acid
4-[(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)sulfamoyl]benzoic acid
Compound characteristics
| Compound ID: | 7202-3059 |
| Compound Name: | 4-[(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)sulfamoyl]benzoic acid |
| Molecular Weight: | 401.41 |
| Molecular Formula: | C18 H11 N O6 S2 |
| Smiles: | c1ccc2c3c(cc(c2c1)NS(c1ccc(cc1)C(O)=O)(=O)=O)SC(=O)O3 |
| Stereo: | ACHIRAL |
| logP: | 3.8494 |
| logD: | 0.7916 |
| logSw: | -4.1509 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.083 |
| InChI Key: | YWOUDFIQSSCSQI-UHFFFAOYSA-N |