dimethyl 3-methyl-5-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}thiophene-2,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 3-methyl-5-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}thiophene-2,4-dicarboxylate
dimethyl 3-methyl-5-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}thiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 4112-4133 |
| Compound Name: | dimethyl 3-methyl-5-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}thiophene-2,4-dicarboxylate |
| Molecular Weight: | 484.55 |
| Molecular Formula: | C22 H20 N4 O5 S2 |
| Smiles: | Cc1cc2nnc(n2c2ccccc12)SCC(Nc1c(C(=O)OC)c(C)c(C(=O)OC)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7221 |
| logD: | 1.8739 |
| logSw: | -4.248 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.373 |
| InChI Key: | WIOJIOAUEOZTQF-UHFFFAOYSA-N |