ethyl 3-[2-(3,5-dimethylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 3-[2-(3,5-dimethylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 3-[2-(3,5-dimethylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | C066-2104 |
| Compound Name: | ethyl 3-[2-(3,5-dimethylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C20 H21 N3 O4 S |
| Smiles: | CCOC(c1c(C)c2C(N(CC(Nc3cc(C)cc(C)c3)=O)C=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2535 |
| logD: | 3.2535 |
| logSw: | -3.3943 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.144 |
| InChI Key: | ZJOMJHRYMCIRFM-UHFFFAOYSA-N |