2-[(3-fluorophenyl)methyl]-4-(2-phenylethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
2-[(3-fluorophenyl)methyl]-4-(2-phenylethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
2-[(3-fluorophenyl)methyl]-4-(2-phenylethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | F816-0252 |
| Compound Name: | 2-[(3-fluorophenyl)methyl]-4-(2-phenylethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C22 H17 F N4 O2 S |
| Smiles: | C(CN1C2=NN(Cc3cccc(c3)F)C(N2c2ccsc2C1=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2704 |
| logD: | 4.2704 |
| logSw: | -4.3452 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.932 |
| InChI Key: | MRORXBUTWABSGR-UHFFFAOYSA-N |