ethyl 4-(3,4-dimethoxyanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 4-(3,4-dimethoxyanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
ethyl 4-(3,4-dimethoxyanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | K824-0038 |
Compound Name: | ethyl 4-(3,4-dimethoxyanilino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate |
Molecular Weight: | 445.49 |
Molecular Formula: | C21 H23 N3 O6 S |
Smiles: | CCOC(c1c(C)c2c(Nc3ccc(c(c3)OC)OC)nc(CC(=O)OC)nc2s1)=O |
Stereo: | ACHIRAL |
logP: | 3.716 |
logD: | 3.7135 |
logSw: | -4.1812 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.05 |
InChI Key: | FTULNWQKVDWYQL-UHFFFAOYSA-N |