1-{[(3,4-dichlorophenyl)methyl]sulfanyl}-5-methyl[1,2,4]triazolo[4,3-a]quinoline
Chemical Structure Depiction of
1-{[(3,4-dichlorophenyl)methyl]sulfanyl}-5-methyl[1,2,4]triazolo[4,3-a]quinoline
1-{[(3,4-dichlorophenyl)methyl]sulfanyl}-5-methyl[1,2,4]triazolo[4,3-a]quinoline
Compound characteristics
Compound ID: | 3993-2732 |
Compound Name: | 1-{[(3,4-dichlorophenyl)methyl]sulfanyl}-5-methyl[1,2,4]triazolo[4,3-a]quinoline |
Molecular Weight: | 374.29 |
Molecular Formula: | C18 H13 Cl2 N3 S |
Smiles: | Cc1cc2nnc(n2c2ccccc12)SCc1ccc(c(c1)[Cl])[Cl] |
Stereo: | ACHIRAL |
logP: | 5.8834 |
logD: | 5.8834 |
logSw: | -6.1802 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 21.0819 |
InChI Key: | PYNNYJVAXRFNBI-UHFFFAOYSA-N |