prop-2-en-1-yl 4-methyl-2-{2-[([1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 4-methyl-2-{2-[([1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
prop-2-en-1-yl 4-methyl-2-{2-[([1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | D308-0246 |
| Compound Name: | prop-2-en-1-yl 4-methyl-2-{2-[([1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 439.51 |
| Molecular Formula: | C20 H17 N5 O3 S2 |
| Smiles: | Cc1c(C(=O)OCC=C)sc(NC(CSc2nnc3ccc4ccccc4n23)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.5797 |
| logD: | 3.5398 |
| logSw: | -3.7751 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.902 |
| InChI Key: | JDXQVEKECLIRBU-UHFFFAOYSA-N |