3-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanoic acid
Chemical Structure Depiction of
3-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanoic acid
3-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanoic acid
Compound characteristics
| Compound ID: | K906-0466 |
| Compound Name: | 3-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanoic acid |
| Molecular Weight: | 271.25 |
| Molecular Formula: | C10 H9 N O6 S |
| Smiles: | C(CS(c1ccc2c(c1)OC(N2)=O)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2374 |
| logD: | -3.8299 |
| logSw: | -1.9126 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.076 |
| InChI Key: | HUHGYAWFBTWHLY-UHFFFAOYSA-N |