4-[(2-ethoxyphenyl)methyl]-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Chemical Structure Depiction of
4-[(2-ethoxyphenyl)methyl]-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
4-[(2-ethoxyphenyl)methyl]-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Compound characteristics
| Compound ID: | C200-7011 |
| Compound Name: | 4-[(2-ethoxyphenyl)methyl]-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C16 H14 N4 O2 S2 |
| Smiles: | CCOc1ccccc1CN1C2=NNC(N2c2ccsc2C1=O)=S |
| Stereo: | ACHIRAL |
| logP: | 3.2584 |
| logD: | -3.139 |
| logSw: | -3.3913 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.603 |
| InChI Key: | YZEJNPKVBHUUBM-UHFFFAOYSA-N |