3-{[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl}-7-(3-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
3-{[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl}-7-(3-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
3-{[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl}-7-(3-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-0694 |
| Compound Name: | 3-{[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl}-7-(3-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 431.47 |
| Molecular Formula: | C22 H17 N5 O3 S |
| Smiles: | COc1cccc(c1)N1C=Cn2c(C1=O)nnc2SCC(c1c[nH]c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5394 |
| logD: | 2.5394 |
| logSw: | -2.9722 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.364 |
| InChI Key: | OMMHHWBDYOQHTL-UHFFFAOYSA-N |