N-[(2-methylphenyl)methyl]-4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxamide
Chemical Structure Depiction of
N-[(2-methylphenyl)methyl]-4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxamide
N-[(2-methylphenyl)methyl]-4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxamide
Compound characteristics
| Compound ID: | E516-0724 |
| Compound Name: | N-[(2-methylphenyl)methyl]-4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxamide |
| Molecular Weight: | 335.4 |
| Molecular Formula: | C20 H21 N3 O2 |
| Smiles: | Cc1ccccc1CNC(c1ccc2c(c1)NC(C1CCCN12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1563 |
| logD: | 3.1557 |
| logSw: | -3.241 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.346 |
| InChI Key: | HQHMVMISUAFINB-SFHVURJKSA-N |