7-(2-methoxyphenyl)-3-{[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(2-methoxyphenyl)-3-{[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(2-methoxyphenyl)-3-{[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
Compound ID: | G802-0375 |
Compound Name: | 7-(2-methoxyphenyl)-3-{[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
Molecular Weight: | 445.5 |
Molecular Formula: | C23 H19 N5 O3 S |
Smiles: | Cc1c(C(CSc2nnc3C(N(C=Cn23)c2ccccc2OC)=O)=O)c2ccccc2[nH]1 |
Stereo: | ACHIRAL |
logP: | 2.2995 |
logD: | 2.2995 |
logSw: | -2.6724 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.205 |
InChI Key: | NRTZCWPAQTVXGE-UHFFFAOYSA-N |