3,4,5-trimethoxy-N-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
3,4,5-trimethoxy-N-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)benzamide
3,4,5-trimethoxy-N-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | L780-0112 |
| Compound Name: | 3,4,5-trimethoxy-N-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C25 H23 N3 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(Nc1ccc(cc1)SCC1C(Nc2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7624 |
| logD: | 3.7624 |
| logSw: | -4.0912 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.926 |
| InChI Key: | OKHHUECVCVDWIX-UHFFFAOYSA-N |