1-(4-ethoxyphenyl)-2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(4-ethoxyphenyl)-2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethan-1-one
1-(4-ethoxyphenyl)-2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | D308-0356 |
| Compound Name: | 1-(4-ethoxyphenyl)-2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 377.46 |
| Molecular Formula: | C21 H19 N3 O2 S |
| Smiles: | CCOc1ccc(cc1)C(CSc1nnc2cc(C)c3ccccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4604 |
| logD: | 4.4604 |
| logSw: | -4.2632 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.452 |
| InChI Key: | SHPHMMKORVMVFL-UHFFFAOYSA-N |