4-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-2-(2-fluorophenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
4-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-2-(2-fluorophenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
4-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-2-(2-fluorophenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-1000 |
| Compound Name: | 4-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-2-(2-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(c2ccccc2F)=NC2=CC(NN12)=O)Oc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8237 |
| logD: | 3.8237 |
| logSw: | -4.5898 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.351 |
| InChI Key: | REFIWZCLEBBCCU-UHFFFAOYSA-N |