1-(2-chlorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-(2-chlorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
1-(2-chlorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | L806-0227 |
Compound Name: | 1-(2-chlorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 435.93 |
Molecular Formula: | C22 H18 Cl N5 O S |
Smiles: | CSc1ccc(CNC(c2c(c3cccnc3)n(c3ccccc3[Cl])nn2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.8286 |
logD: | 3.8286 |
logSw: | -4.1692 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.47 |
InChI Key: | WZJMEVLCTUZTBU-UHFFFAOYSA-N |