N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[(3-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[(3-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[(3-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | K977-0167 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[(3-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 537.63 |
| Molecular Formula: | C28 H31 N3 O6 S |
| Smiles: | Cc1cccc(CS(CC2C(Nc3cc(ccc3N2)C(NCCc2ccc(c(c2)OC)OC)=O)=O)(=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6799 |
| logD: | 2.6795 |
| logSw: | -3.0294 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.914 |
| InChI Key: | SXWSCJGVHNFKGV-DEOSSOPVSA-N |