N-[(2-methylphenyl)methyl]-2-[6-oxo-3-(pyrrolidine-1-sulfonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]acetamide
Chemical Structure Depiction of
N-[(2-methylphenyl)methyl]-2-[6-oxo-3-(pyrrolidine-1-sulfonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]acetamide
N-[(2-methylphenyl)methyl]-2-[6-oxo-3-(pyrrolidine-1-sulfonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]acetamide
Compound characteristics
| Compound ID: | G672-0333 |
| Compound Name: | N-[(2-methylphenyl)methyl]-2-[6-oxo-3-(pyrrolidine-1-sulfonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]acetamide |
| Molecular Weight: | 496.63 |
| Molecular Formula: | C26 H32 N4 O4 S |
| Smiles: | Cc1ccccc1CNC(CN1C(C2CCCCN2c2ccc(cc12)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.516 |
| logD: | 3.516 |
| logSw: | -3.8548 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.34 |
| InChI Key: | SPQRGWDFESGVEL-HSZRJFAPSA-N |