4-[(4-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-[(4-methoxyphenyl)methyl]-2-(2-phenoxyethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
4-[(4-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: | F816-0218 |
| Compound Name: | 4-[(4-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: | COc1ccc(CN2C3=NN(CCOc4ccccc4)C(N3c3ccsc3C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2087 |
| logD: | 4.2087 |
| logSw: | -4.1429 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.894 |
| InChI Key: | DAPITIUUVQWFHQ-UHFFFAOYSA-N |