2-(3-methoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(3-methoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
Compound ID: | G199-1502 |
Compound Name: | 2-(3-methoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
Molecular Weight: | 378.45 |
Molecular Formula: | C20 H18 N4 O2 S |
Smiles: | Cc1ccc(CSC2=NC(c3cccc(c3)OC)=NC3=CC(NN23)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.5075 |
logD: | 3.5075 |
logSw: | -3.7565 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.477 |
InChI Key: | YZWXBLFIFCQXTM-UHFFFAOYSA-N |