sodium--4-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}benzene-1-sulfonate (1/1)
Chemical Structure Depiction of
sodium--4-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}benzene-1-sulfonate (1/1)
sodium--4-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}benzene-1-sulfonate (1/1)
Compound characteristics
| Compound ID: | 8008-0661 |
| Compound Name: | sodium--4-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}benzene-1-sulfonate (1/1) |
| Molecular Weight: | 411.36 |
| Molecular Formula: | C18 H14 N O7 S |
| Salt: | Na+ |
| Smiles: | CC1=CC(=O)Oc2cc(ccc12)OCC(Nc1ccc(cc1)S([O-])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2295 |
| logD: | -0.2298 |
| logSw: | -2.2537 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.437 |
| InChI Key: | UTCAGNQQYBAYSD-UHFFFAOYSA-M |