ethyl 3-[2-(2-bromo-4-methylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 3-[2-(2-bromo-4-methylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 3-[2-(2-bromo-4-methylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | C066-1867 |
| Compound Name: | ethyl 3-[2-(2-bromo-4-methylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 464.34 |
| Molecular Formula: | C19 H18 Br N3 O4 S |
| Smiles: | CCOC(c1c(C)c2C(N(CC(Nc3ccc(C)cc3[Br])=O)C=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3419 |
| logD: | 3.3419 |
| logSw: | -3.5819 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.446 |
| InChI Key: | USKPDBUFHMAFOQ-UHFFFAOYSA-N |