ethyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K285-0310 |
| Compound Name: | ethyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 538.68 |
| Molecular Formula: | C28 H30 N2 O5 S2 |
| Smiles: | CCOC(c1c(C)c2C(N(CCc3ccc(c(c3)OC)OC)C(=Nc2s1)SCc1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9822 |
| logD: | 5.9822 |
| logSw: | -5.4919 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.666 |
| InChI Key: | QMKIRGBCLIUOQR-UHFFFAOYSA-N |