ethyl 4-(4-chlorophenyl)-2-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-chlorophenyl)-2-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}thiophene-3-carboxylate
ethyl 4-(4-chlorophenyl)-2-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5702-4536 |
| Compound Name: | ethyl 4-(4-chlorophenyl)-2-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 537.06 |
| Molecular Formula: | C26 H21 Cl N4 O3 S2 |
| Smiles: | CCOC(c1c(csc1NC(CSc1nnc2cc(C)c3ccccc3n12)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.1779 |
| logD: | 6.167 |
| logSw: | -6.0814 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.508 |
| InChI Key: | HARLTMIDQBEQAH-UHFFFAOYSA-N |