4-[(2-methoxyphenyl)methyl]-2-(2-phenoxyethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
4-[(2-methoxyphenyl)methyl]-2-(2-phenoxyethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
4-[(2-methoxyphenyl)methyl]-2-(2-phenoxyethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | F816-0320 |
| Compound Name: | 4-[(2-methoxyphenyl)methyl]-2-(2-phenoxyethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 448.5 |
| Molecular Formula: | C23 H20 N4 O4 S |
| Smiles: | COc1ccccc1CN1C2=NN(CCOc3ccccc3)C(N2c2ccsc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1783 |
| logD: | 4.1783 |
| logSw: | -4.2162 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.98 |
| InChI Key: | XKLZBIGMZZKHDE-UHFFFAOYSA-N |