N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | K977-0133 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 481.61 |
| Molecular Formula: | C26 H31 N3 O4 S |
| Smiles: | Cc1ccccc1CS(CC1C(Nc2cc(ccc2N1)C(NCCC1CCCCC=1)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6319 |
| logD: | 3.6315 |
| logSw: | -3.8603 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.845 |
| InChI Key: | PUHWSMUAAXIDLI-DEOSSOPVSA-N |