2-(2-chlorophenyl)-4-({2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}sulfanyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
2-(2-chlorophenyl)-4-({2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}sulfanyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(2-chlorophenyl)-4-({2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}sulfanyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
Compound ID: | G199-0530 |
Compound Name: | 2-(2-chlorophenyl)-4-({2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}sulfanyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
Molecular Weight: | 454.98 |
Molecular Formula: | C23 H23 Cl N4 O2 S |
Smiles: | CC(C)c1ccc(C)cc1OCCSC1=NC(c2ccccc2[Cl])=NC2=CC(NN12)=O |
Stereo: | ACHIRAL |
logP: | 5.4383 |
logD: | 5.4383 |
logSw: | -5.7442 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.437 |
InChI Key: | PSRJBEKEPHEEBY-UHFFFAOYSA-N |