4-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-methylphenyl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
4-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-methylphenyl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
4-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-methylphenyl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | F816-0269 |
| Compound Name: | 4-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-methylphenyl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 476.55 |
| Molecular Formula: | C25 H24 N4 O4 S |
| Smiles: | Cc1cccc(CN2C(N3C(=N2)N(CCc2ccc(c(c2)OC)OC)C(c2c3ccs2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3119 |
| logD: | 4.3119 |
| logSw: | -4.3582 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.193 |
| InChI Key: | CIVYQDRKNQQTST-UHFFFAOYSA-N |