4-[(4-ethylphenyl)methyl]-2-[2-(4-methoxyphenyl)-2-oxoethyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
4-[(4-ethylphenyl)methyl]-2-[2-(4-methoxyphenyl)-2-oxoethyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
4-[(4-ethylphenyl)methyl]-2-[2-(4-methoxyphenyl)-2-oxoethyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | F816-0531 |
| Compound Name: | 4-[(4-ethylphenyl)methyl]-2-[2-(4-methoxyphenyl)-2-oxoethyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 474.54 |
| Molecular Formula: | C25 H22 N4 O4 S |
| Smiles: | CCc1ccc(CN2C3=NN(CC(c4ccc(cc4)OC)=O)C(N3c3ccsc3C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4404 |
| logD: | 4.4404 |
| logSw: | -4.2378 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.744 |
| InChI Key: | JGNMKXRJXXJEMG-UHFFFAOYSA-N |