2-[(3-benzylquinoxalin-2-yl)sulfanyl]-N-[(3,4,5-triethoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[(3-benzylquinoxalin-2-yl)sulfanyl]-N-[(3,4,5-triethoxyphenyl)methyl]acetamide
2-[(3-benzylquinoxalin-2-yl)sulfanyl]-N-[(3,4,5-triethoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | C066-5380 |
| Compound Name: | 2-[(3-benzylquinoxalin-2-yl)sulfanyl]-N-[(3,4,5-triethoxyphenyl)methyl]acetamide |
| Molecular Weight: | 531.67 |
| Molecular Formula: | C30 H33 N3 O4 S |
| Smiles: | CCOc1cc(CNC(CSc2c(Cc3ccccc3)nc3ccccc3n2)=O)cc(c1OCC)OCC |
| Stereo: | ACHIRAL |
| logP: | 5.6597 |
| logD: | 5.6597 |
| logSw: | -5.419 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.214 |
| InChI Key: | YMFUAEAFGCNNHQ-UHFFFAOYSA-N |