N-(4-chlorophenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
N-(4-chlorophenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D308-0252 |
| Compound Name: | N-(4-chlorophenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide |
| Molecular Weight: | 412.9 |
| Molecular Formula: | C20 H17 Cl N4 O2 S |
| Smiles: | Cc1cc2nnc(n2c2c(cccc12)OC)SCC(Nc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5438 |
| logD: | 4.5437 |
| logSw: | -4.8023 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.638 |
| InChI Key: | VCYBKROPOATQFQ-UHFFFAOYSA-N |