2-[3-(dimethylsulfamoyl)-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[3-(dimethylsulfamoyl)-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[3-(dimethylsulfamoyl)-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | G672-0096 |
| Compound Name: | 2-[3-(dimethylsulfamoyl)-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 488.63 |
| Molecular Formula: | C23 H28 N4 O4 S2 |
| Smiles: | CN(C)S(c1ccc2c(c1)N(CC(Nc1cccc(c1)SC)=O)C(C1CCCCN12)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0822 |
| logD: | 3.0822 |
| logSw: | -3.5634 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.605 |
| InChI Key: | DDLBUSYDANFTJQ-HXUWFJFHSA-N |