2-(4-methylphenoxy)-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-(4-methylphenoxy)-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
2-(4-methylphenoxy)-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
Compound ID: | L784-0038 |
Compound Name: | 2-(4-methylphenoxy)-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide |
Molecular Weight: | 439.51 |
Molecular Formula: | C20 H17 N5 O3 S2 |
Smiles: | Cc1ccc(cc1)OCC(Nc1nnc(SCC2C(Nc3ccccc3N=2)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 3.889 |
logD: | 3.8873 |
logSw: | -3.9226 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.14 |
InChI Key: | WWECCVFNWBDGJR-UHFFFAOYSA-N |