7-(4-ethoxyphenyl)-3-sulfanylidene-2,3-dihydro[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(4-ethoxyphenyl)-3-sulfanylidene-2,3-dihydro[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(4-ethoxyphenyl)-3-sulfanylidene-2,3-dihydro[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | C200-6567 |
| Compound Name: | 7-(4-ethoxyphenyl)-3-sulfanylidene-2,3-dihydro[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 288.33 |
| Molecular Formula: | C13 H12 N4 O2 S |
| Smiles: | CCOc1ccc(cc1)N1C=CN2C(C1=O)=NNC2=S |
| Stereo: | ACHIRAL |
| logP: | 1.1493 |
| logD: | -1.8874 |
| logSw: | -2.2719 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.94 |
| InChI Key: | VESOZEHFXFSRMW-UHFFFAOYSA-N |