methyl 4-[(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)amino]benzoate
methyl 4-[(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)amino]benzoate
Compound characteristics
| Compound ID: | C515-0196 |
| Compound Name: | methyl 4-[(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)amino]benzoate |
| Molecular Weight: | 403.41 |
| Molecular Formula: | C18 H17 N3 O6 S |
| Smiles: | CN1C(C(N(C)c2cc(ccc12)S(Nc1ccc(cc1)C(=O)OC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3649 |
| logD: | 1.2241 |
| logSw: | -2.5159 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.421 |
| InChI Key: | HNYBLBYIIGDAFU-UHFFFAOYSA-N |