butyl 2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Chemical Structure Depiction of
butyl 2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
butyl 2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Compound characteristics
| Compound ID: | 5122-1846 |
| Compound Name: | butyl 2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate |
| Molecular Weight: | 448.52 |
| Molecular Formula: | C25 H28 N4 O4 |
| Smiles: | CCCCOC(c1c2c(nc3ccccc3n2)n(CCc2ccc(c(c2)OC)OC)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 4.369 |
| logD: | 4.369 |
| logSw: | -4.472 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.526 |
| InChI Key: | CJYKFGMMQUVKHB-UHFFFAOYSA-N |