AC1M1URY
2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(4-fluorophenyl)acetamide
Also Known As: Oprea1_624244|NCGC00135696-01|G856-1092|2-{[3-(4-ethoxyphenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide|F0580-0583|2-((3-(4-ethoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)-N-(4-fluorophenyl)acetamide|2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(4-fluorophenyl)acetamide
| Molecular Formula | C26H21FN4O3S |
|---|---|
| Molecular Weight | 488.13184 g/mol |
| LogP | 5.1356 |
| Topological Polar Surface Area | 89.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 488.13184 |
| Monoisotopic Mass | 488.13184 |
| Heavy Atoms | 35 |
| Complexity | 1577.3975 |
Chemical Identifiers
| CAS Number | 536708-30-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC(=O)NC5=CC=C(C=C5)F |
Product Overview
AC1M1URY (CAS 536708-30-2), with molecular formula C26H21FN4O3S and molecular weight 488.13184 g/mol. IUPAC: 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(4-fluorophenyl)acetamide.
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