AC1MVR67
ethyl 4-[4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: Oprea1_333952|AK-968/15257290|ethyl 4-[4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate|ethyl 4-[4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate|ethyl 4-(4-(cyanomethoxy)-3-ethoxy-5-iodophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|ethyl 4-[4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C18H20IN3O5 |
|---|---|
| Molecular Weight | 485.04477 g/mol |
| LogP | 2.78328 |
| Topological Polar Surface Area | 109.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 485.04477 |
| Monoisotopic Mass | 485.04477 |
| Heavy Atoms | 27 |
| Complexity | 815.9505 |
Chemical Identifiers
| CAS Number | 445288-41-5 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC)I)OCC#N |
Product Overview
AC1MVR67 (CAS 445288-41-5), with molecular formula C18H20IN3O5 and molecular weight 485.04477 g/mol. IUPAC: ethyl 4-[4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
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