1-(4-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-(4-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
1-(4-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | L806-1227 |
Compound Name: | 1-(4-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 405.45 |
Molecular Formula: | C21 H16 F N5 O S |
Smiles: | CSc1cccc(c1)NC(c1c(c2cccnc2)n(c2ccc(cc2)F)nn1)=O |
Stereo: | ACHIRAL |
logP: | 3.5916 |
logD: | 3.5915 |
logSw: | -3.6663 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.448 |
InChI Key: | GXZHGWVCBGZTIW-UHFFFAOYSA-N |