AC1MYTQ7
benzyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-(2-oxo-2-propoxyethyl)sulfanyl-1,4-dihydropyridine-3-carboxylate
Also Known As: benzyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-((2-oxo-2-propoxyethyl)thio)-1,4-dihydropyridine-3-carboxylate|benzyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-(2-oxo-2-propoxyethyl)sulfanyl-1,4-dihydropyridine-3-carboxylate|benzyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-[(2-oxo-2-propoxyethyl)sulfanyl]-1,4-dihydropyridine-3-carboxylate
| Molecular Formula | C26H25ClN2O4S |
|---|---|
| Molecular Weight | 496.12234 g/mol |
| LogP | 5.46578 |
| Topological Polar Surface Area | 88.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 496.12234 |
| Monoisotopic Mass | 496.12234 |
| Heavy Atoms | 34 |
| Complexity | 1154.8906 |
Chemical Identifiers
| CAS Number | 799784-26-2 |
|---|---|
| SMILES | CCCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3Cl)C#N |
Product Overview
AC1MYTQ7 (CAS 799784-26-2), with molecular formula C26H25ClN2O4S and molecular weight 496.12234 g/mol. IUPAC: benzyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-(2-oxo-2-propoxyethyl)sulfanyl-1,4-dihydropyridine-3-carboxylate.
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