ethyl 3-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 3-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 3-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | C066-1876 |
| Compound Name: | ethyl 3-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 419.89 |
| Molecular Formula: | C19 H18 Cl N3 O4 S |
| Smiles: | CCOC(c1c(C)c2C(N(CC(Nc3cc(ccc3C)[Cl])=O)C=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0177 |
| logD: | 3.0175 |
| logSw: | -3.7231 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.446 |
| InChI Key: | KFWDIOQEORGMJL-UHFFFAOYSA-N |