methyl {6-[(4-cyanophenyl)sulfamoyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
Chemical Structure Depiction of
methyl {6-[(4-cyanophenyl)sulfamoyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
methyl {6-[(4-cyanophenyl)sulfamoyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate
Compound characteristics
| Compound ID: | F064-0128 |
| Compound Name: | methyl {6-[(4-cyanophenyl)sulfamoyl]-2-oxo-1,3-benzoxazol-3(2H)-yl}acetate |
| Molecular Weight: | 387.37 |
| Molecular Formula: | C17 H13 N3 O6 S |
| Smiles: | COC(CN1C(=O)Oc2cc(ccc12)S(Nc1ccc(C#N)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5585 |
| logD: | 1.4492 |
| logSw: | -2.61 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.623 |
| InChI Key: | AGUWEIACIFEATR-UHFFFAOYSA-N |