3-acetyl-4-propyl-1-(pyridin-2-yl)-1,3,3a,4,9,9a-hexahydro-2H-pyrrolo[2,3-b]quinoxalin-2-one
Chemical Structure Depiction of
3-acetyl-4-propyl-1-(pyridin-2-yl)-1,3,3a,4,9,9a-hexahydro-2H-pyrrolo[2,3-b]quinoxalin-2-one
3-acetyl-4-propyl-1-(pyridin-2-yl)-1,3,3a,4,9,9a-hexahydro-2H-pyrrolo[2,3-b]quinoxalin-2-one
Compound characteristics
| Compound ID: | 8016-0950 |
| Compound Name: | 3-acetyl-4-propyl-1-(pyridin-2-yl)-1,3,3a,4,9,9a-hexahydro-2H-pyrrolo[2,3-b]quinoxalin-2-one |
| Molecular Weight: | 350.42 |
| Molecular Formula: | C20 H22 N4 O2 |
| Smiles: | [H]N1C2C(C(C(C)=O)C(N2c2ccccn2)=O)N(CCC)c2ccccc12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6191 |
| logD: | -2.1275 |
| logSw: | -2.8753 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.104 |
| InChI Key: | XHCVDCSJWAWHGQ-UHFFFAOYSA-N |