4-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-2-(4-fluorophenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
4-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-2-(4-fluorophenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
4-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-2-(4-fluorophenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
Compound ID: | G199-1232 |
Compound Name: | 4-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-2-(4-fluorophenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
Molecular Weight: | 416.86 |
Molecular Formula: | C19 H14 Cl F N4 O2 S |
Smiles: | C(CSC1=NC(c2ccc(cc2)F)=NC2=CC(NN12)=O)Oc1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.9312 |
logD: | 3.9312 |
logSw: | -4.5023 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.351 |
InChI Key: | ZWWPEOVXVWZNTI-UHFFFAOYSA-N |