dimethyl 5-[(3-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carbonyl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(3-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carbonyl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(3-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carbonyl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | E213-0806 |
| Compound Name: | dimethyl 5-[(3-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carbonyl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 455.49 |
| Molecular Formula: | C22 H21 N3 O6 S |
| Smiles: | Cc1c2C(N3CCCCC3=Nc2sc1C(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1583 |
| logD: | 3.1464 |
| logSw: | -3.4441 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.73 |
| InChI Key: | ZNKZFIYYURQWAW-UHFFFAOYSA-N |