benzyl 3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinoxaline-2-carboxylate
Chemical Structure Depiction of
benzyl 3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinoxaline-2-carboxylate
benzyl 3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | C301-9349 |
| Compound Name: | benzyl 3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinoxaline-2-carboxylate |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C26 H25 N3 O4 |
| Smiles: | COc1ccc(CCNc2c(C(=O)OCc3ccccc3)nc3ccccc3n2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.4034 |
| logD: | 4.4034 |
| logSw: | -4.6531 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.776 |
| InChI Key: | JTWOWDOQBAERLH-UHFFFAOYSA-N |