methyl 4-[2-(4-oxo-7-phenylthieno[3,2-d]pyrimidin-3(4H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(4-oxo-7-phenylthieno[3,2-d]pyrimidin-3(4H)-yl)acetamido]benzoate
methyl 4-[2-(4-oxo-7-phenylthieno[3,2-d]pyrimidin-3(4H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | L114-0113 |
| Compound Name: | methyl 4-[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(c1ccc(cc1)NC(CN1C=Nc2c(csc2C1=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7378 |
| logD: | 3.7377 |
| logSw: | -4.0844 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.157 |
| InChI Key: | AHIPPABMLXKTMX-UHFFFAOYSA-N |