2-[5-(4-ethoxyphenyl)-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl]propanoic acid
2-[5-(4-ethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoic acid
Also Known As: Oprea1_526332|BAS 05150811|2-[5-(4-ethoxyphenyl)-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl]propanoic acid|SR-01000366862-1|2-[5-(4-Ethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]propionic acid|2-[5-(4-ethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoic acid|2-[5-(4-ethoxyphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoic acid|2-(5-(4-Ethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)propanoic acid|2-[5-(4-Ethoxy-phenyl)-4-oxo-4H-thieno[2,3-d]pyrimidin-3-yl]-propionic acid|2-[5-(4-ethoxyphenyl)-4-oxo-3-hydrothiopheno[2,3-d]pyrimidin-3-yl]propanoic ac id
| Molecular Formula | C17H16N2O4S |
|---|---|
| Molecular Weight | 344.08307 g/mol |
| LogP | 3.1693 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.08307 |
| Monoisotopic Mass | 344.08307 |
| Heavy Atoms | 24 |
| Complexity | 943.3741 |
Chemical Identifiers
| CAS Number | 446830-95-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)C(C)C(=O)O |
Product Overview
2-[5-(4-ethoxyphenyl)-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl]propanoic acid (CAS 446830-95-1), with molecular formula C17H16N2O4S and molecular weight 344.08307 g/mol. IUPAC: 2-[5-(4-ethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoic acid.