3-(2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanoic acid
Chemical Structure Depiction of
3-(2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanoic acid
3-(2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanoic acid
Compound characteristics
| Compound ID: | R052-2812 |
| Compound Name: | 3-(2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanoic acid |
| Molecular Weight: | 298.27 |
| Molecular Formula: | C11 H10 N2 O6 S |
| Smiles: | C(CS(c1ccc2c(c1)NC(C(N2)=O)=O)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.2779 |
| logD: | -4.8703 |
| logSw: | -1.8076 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.493 |
| InChI Key: | OZVDBHVMLBWBKC-UHFFFAOYSA-N |