ethyl 2-({2-[4-(dimethylamino)anilino]-2-oxoethyl}sulfanyl)-3-[(furan-2-yl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-({2-[4-(dimethylamino)anilino]-2-oxoethyl}sulfanyl)-3-[(furan-2-yl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 2-({2-[4-(dimethylamino)anilino]-2-oxoethyl}sulfanyl)-3-[(furan-2-yl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K285-0089 |
| Compound Name: | ethyl 2-({2-[4-(dimethylamino)anilino]-2-oxoethyl}sulfanyl)-3-[(furan-2-yl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 526.63 |
| Molecular Formula: | C25 H26 N4 O5 S2 |
| Smiles: | CCOC(c1c(C)c2C(N(Cc3ccco3)C(=Nc2s1)SCC(Nc1ccc(cc1)N(C)C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3073 |
| logD: | 4.2987 |
| logSw: | -4.2196 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.13 |
| InChI Key: | AZQYEICDNIJEBB-UHFFFAOYSA-N |