N-butyl-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
N-butyl-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
N-butyl-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | K977-0138 |
| Compound Name: | N-butyl-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C22 H27 N3 O4 S |
| Smiles: | CCCCNC(c1ccc2c(c1)NC(C(CS(Cc1ccccc1C)(=O)=O)N2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1404 |
| logD: | 3.14 |
| logSw: | -3.3503 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.924 |
| InChI Key: | BRIAQOUCMVCXFD-FQEVSTJZSA-N |