AC1MFXKQ
2-(6-ethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-nitrophenyl)acetamide
Also Known As: CBKinase1_006049|CBKinase1_018449|2-((6-ethyl-4-oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)-N-(4-nitrophenyl)acetamide|BRD-K37397742-001-01-3|F1684-0197|2-({6-ethyl-4-oxo-3-phenyl-3H,4H-thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(4-nitrophenyl)acetamide|2-(6-ethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-nitrophenyl)acetamide|2-[(6-ethyl-4-oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide
| Molecular Formula | C22H18N4O4S2 |
|---|---|
| Molecular Weight | 466.07693 g/mol |
| LogP | 4.6486 |
| Topological Polar Surface Area | 107.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 466.07693 |
| Monoisotopic Mass | 466.07693 |
| Heavy Atoms | 32 |
| Complexity | 1348.3711 |
Chemical Identifiers
| CAS Number | 378775-68-9 |
|---|---|
| SMILES | CCC1=CC2=C(S1)N=C(N(C2=O)C3=CC=CC=C3)SCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
AC1MFXKQ (CAS 378775-68-9), with molecular formula C22H18N4O4S2 and molecular weight 466.07693 g/mol. IUPAC: 2-(6-ethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-nitrophenyl)acetamide.