N-[(3-bromophenyl)methyl]-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
N-[(3-bromophenyl)methyl]-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
Compound characteristics
| Compound ID: | G587-0302 |
| Compound Name: | N-[(3-bromophenyl)methyl]-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide |
| Molecular Weight: | 414.3 |
| Molecular Formula: | C20 H20 Br N3 O2 |
| Smiles: | C1CCN2C(C1)C(Nc1cc(ccc12)C(NCc1cccc(c1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5159 |
| logD: | 3.5153 |
| logSw: | -3.676 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.98 |
| InChI Key: | UQNJEBFBWXOMJS-GOSISDBHSA-N |