N-[3-(methylsulfanyl)phenyl]-2-[6-oxo-3-(piperidine-1-carbonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-[6-oxo-3-(piperidine-1-carbonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]acetamide
N-[3-(methylsulfanyl)phenyl]-2-[6-oxo-3-(piperidine-1-carbonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]acetamide
Compound characteristics
| Compound ID: | G673-0751 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-[6-oxo-3-(piperidine-1-carbonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]acetamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C27 H32 N4 O3 S |
| Smiles: | CSc1cccc(c1)NC(CN1C(C2CCCCN2c2ccc(cc12)C(N1CCCCC1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3502 |
| logD: | 3.3502 |
| logSw: | -3.7986 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.589 |
| InChI Key: | DEPCUZIQTFVADU-HSZRJFAPSA-N |