HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-{[(2-Chlorophenoxy)acetyl]amino}-4-phenylthiophene-3-carboxamide
2-{[(2-chlorophenoxy)acetyl]amino}-4-phenylthiophene-3-carboxamide · 3-Thiophenecarboxamide, 2-[[2-(2-chlorophenoxy)acetyl]amino]-4-phenyl-
![2-{[(2-Chlorophenoxy)acetyl]amino}-4-phenylthiophene-3-carboxamide molecular structure](/img/chemical/178819822.png)
Identifiers & Physical Properties
| CAS No. | 495395-22-7 |
|---|---|
| Molecular formula | C19H15ClN2O3S |
| Average molar mass | 386.9 g/mol |
| SMILES | NC(=O)c1c(-c2ccccc2)csc1NC(=O)COc1ccccc1Cl |
| InChIKey | ZEZQJFWHTWVOHW-UHFFFAOYSA-N |
Chemical & Physical Properties
| XLogP | 4.5 |
|---|---|
| Topological polar surface area | 110 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 6 |
| Heavy atoms | 26 |
| Formal charge | 0 |
| Complexity | 501 |
| Boiling point | 604.7±55.0 °C(Predicted) |
| Density | 1.399±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 12.24±0.70(Predicted) |