7-(2-methoxyphenyl)-3-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(2-methoxyphenyl)-3-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(2-methoxyphenyl)-3-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
Compound ID: | G802-0367 |
Compound Name: | 7-(2-methoxyphenyl)-3-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
Molecular Weight: | 422.46 |
Molecular Formula: | C21 H18 N4 O4 S |
Smiles: | COc1cccc(c1)C(CSc1nnc2C(N(C=Cn12)c1ccccc1OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.0656 |
logD: | 2.0656 |
logSw: | -2.5459 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 66.822 |
InChI Key: | DTXLGOUOMRAPNO-UHFFFAOYSA-N |