3-(2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanenitrile
Chemical Structure Depiction of
3-(2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanenitrile
3-(2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanenitrile
Compound characteristics
| Compound ID: | 8014-4303 |
| Compound Name: | 3-(2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanenitrile |
| Molecular Weight: | 279.27 |
| Molecular Formula: | C11 H9 N3 O4 S |
| Smiles: | C(CS(c1ccc2c(c1)NC(C(N2)=O)=O)(=O)=O)C#N |
| Stereo: | ACHIRAL |
| logP: | -1.0688 |
| logD: | -1.5869 |
| logSw: | -2.1141 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.601 |
| InChI Key: | HFBZWXHTBZJBRO-UHFFFAOYSA-N |