1-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinoline
Chemical Structure Depiction of
1-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinoline
1-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinoline
Compound characteristics
| Compound ID: | D308-0460 |
| Compound Name: | 1-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinoline |
| Molecular Weight: | 399.9 |
| Molecular Formula: | C20 H18 Cl N3 O2 S |
| Smiles: | Cc1cc2nnc(n2c2c(cccc12)OC)SCCOc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7571 |
| logD: | 4.7571 |
| logSw: | -4.8938 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.993 |
| InChI Key: | BGPMEMHXMWLCGQ-UHFFFAOYSA-N |