N-[2-(4-chlorophenyl)ethyl]-5-methyl-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-5-methyl-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
N-[2-(4-chlorophenyl)ethyl]-5-methyl-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
Compound characteristics
Compound ID: | G587-0420 |
Compound Name: | N-[2-(4-chlorophenyl)ethyl]-5-methyl-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide |
Molecular Weight: | 397.9 |
Molecular Formula: | C22 H24 Cl N3 O2 |
Smiles: | CN1C(C2CCCCN2c2ccc(cc12)C(NCCc1ccc(cc1)[Cl])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.8464 |
logD: | 2.8464 |
logSw: | -3.7594 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.084 |
InChI Key: | DTHDWUUPVAEYME-LJQANCHMSA-N |