dimethyl 5-[(3-ethyl-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(3-ethyl-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(3-ethyl-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | K821-0072 |
| Compound Name: | dimethyl 5-[(3-ethyl-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 429.45 |
| Molecular Formula: | C20 H19 N3 O6 S |
| Smiles: | CCN1C=Nc2c(C1=O)c(C)c(C(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.8834 |
| logD: | 2.8715 |
| logSw: | -3.2568 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.676 |
| InChI Key: | NJQHBLBURWSNFJ-UHFFFAOYSA-N |