N-[(3-bromophenyl)methyl]-5-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]-5-methyl-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
N-[(3-bromophenyl)methyl]-5-methyl-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
Compound characteristics
| Compound ID: | G587-0637 |
| Compound Name: | N-[(3-bromophenyl)methyl]-5-methyl-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide |
| Molecular Weight: | 428.33 |
| Molecular Formula: | C21 H22 Br N3 O2 |
| Smiles: | CN1C(C2CCCCN2c2ccc(cc12)C(NCc1cccc(c1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.071 |
| logD: | 3.071 |
| logSw: | -3.4069 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.242 |
| InChI Key: | BGDZQNHGEGOSJI-GOSISDBHSA-N |