methyl 2-[2-(4-oxo-7-phenylthieno[3,2-d]pyrimidin-3(4H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-(4-oxo-7-phenylthieno[3,2-d]pyrimidin-3(4H)-yl)acetamido]benzoate
methyl 2-[2-(4-oxo-7-phenylthieno[3,2-d]pyrimidin-3(4H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | L114-0110 |
| Compound Name: | methyl 2-[2-(4-oxo-7-phenylthieno[3,2-d]pyrimidin-3(4H)-yl)acetamido]benzoate |
| Molecular Weight: | 419.46 |
| Molecular Formula: | C22 H17 N3 O4 S |
| Smiles: | COC(c1ccccc1NC(CN1C=Nc2c(csc2C1=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3716 |
| logD: | 3.3609 |
| logSw: | -3.7143 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.459 |
| InChI Key: | QSGIYNDDHWDWIX-UHFFFAOYSA-N |