2-(4-methoxyphenyl)-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-(4-methoxyphenyl)-4-({2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}sulfanyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(4-methoxyphenyl)-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: | G199-1574 |
Compound Name: | 2-(4-methoxyphenyl)-4-({2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}sulfanyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
Molecular Weight: | 450.56 |
Molecular Formula: | C24 H26 N4 O3 S |
Smiles: | CC(C)c1ccc(C)cc1OCCSC1=NC(c2ccc(cc2)OC)=NC2=CC(NN12)=O |
Stereo: | ACHIRAL |
logP: | 5.0075 |
logD: | 5.0075 |
logSw: | -4.5503 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.981 |
InChI Key: | YPGNYKFXSVSKRP-UHFFFAOYSA-N |