ethyl 2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K285-0263 |
| Compound Name: | ethyl 2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 552.67 |
| Molecular Formula: | C28 H28 N2 O6 S2 |
| Smiles: | CCOC(c1c(C)c2C(N(Cc3ccc(cc3)OC)C(=Nc2s1)SCc1cc(ccc1OC)C(C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2286 |
| logD: | 5.2286 |
| logSw: | -5.2236 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.428 |
| InChI Key: | BJJJRGLXYXNDEE-UHFFFAOYSA-N |