1,4-dimethyl-N-[3-(methylsulfanyl)phenyl]-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide
Chemical Structure Depiction of
1,4-dimethyl-N-[3-(methylsulfanyl)phenyl]-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide
1,4-dimethyl-N-[3-(methylsulfanyl)phenyl]-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide
Compound characteristics
| Compound ID: | C515-0145 |
| Compound Name: | 1,4-dimethyl-N-[3-(methylsulfanyl)phenyl]-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C17 H17 N3 O4 S2 |
| Smiles: | CN1C(C(N(C)c2cc(ccc12)S(Nc1cccc(c1)SC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7021 |
| logD: | 1.6969 |
| logSw: | -2.6426 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.247 |
| InChI Key: | CVHCEIHAZGECMU-UHFFFAOYSA-N |