4-[(4-propoxyphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
4-[(4-propoxyphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
4-[(4-propoxyphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | C200-7479 |
| Compound Name: | 4-[(4-propoxyphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 514.53 |
| Molecular Formula: | C25 H21 F3 N4 O3 S |
| Smiles: | CCCOc1ccc(CN2C3=NN(Cc4cccc(c4)C(F)(F)F)C(N3c3ccsc3C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7653 |
| logD: | 5.7653 |
| logSw: | -5.5573 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.371 |
| InChI Key: | RPOOHAVGRRLCJS-UHFFFAOYSA-N |