methyl 2-{2-[7-(4-methylphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[7-(4-methylphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamido}benzoate
methyl 2-{2-[7-(4-methylphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | L114-0233 |
| Compound Name: | methyl 2-{2-[7-(4-methylphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 433.48 |
| Molecular Formula: | C23 H19 N3 O4 S |
| Smiles: | Cc1ccc(cc1)c1csc2C(N(CC(Nc3ccccc3C(=O)OC)=O)C=Nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9001 |
| logD: | 3.8894 |
| logSw: | -4.0178 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.459 |
| InChI Key: | KEXCGVJISMXOMI-UHFFFAOYSA-N |