N-[(5-bromo-2-methoxyphenyl)methyl]-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide
Compound characteristics
| Compound ID: | G587-0280 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-6-oxo-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline-3-carboxamide |
| Molecular Weight: | 444.33 |
| Molecular Formula: | C21 H22 Br N3 O3 |
| Smiles: | COc1ccc(cc1CNC(c1ccc2c(c1)NC(C1CCCCN12)=O)=O)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6563 |
| logD: | 3.6557 |
| logSw: | -3.8986 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.61 |
| InChI Key: | FMCHRHYBMGKQLL-GOSISDBHSA-N |