AC1MW01S
ethyl 5-cyano-4-(2-fluorophenyl)-2-oxo-6-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl-3,4-dihydro-1H-pyridine-3-carboxylate
Also Known As: ethyl 5-cyano-4-(2-fluorophenyl)-2-oxo-6-({2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}sulfanyl)-1,2,3,4-tetrahydropyridine-3-carboxylate|ethyl 5-cyano-4-(2-fluorophenyl)-2-oxo-6-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl-3,4-dihydro-1H-pyridine-3-carboxylate|ethyl 5-cyano-4-(2-fluorophenyl)-6-((2-(mesitylamino)-2-oxoethyl)thio)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
| Molecular Formula | C26H26FN3O4S |
|---|---|
| Molecular Weight | 495.1628 g/mol |
| LogP | 4.25074 |
| Topological Polar Surface Area | 108.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 495.1628 |
| Monoisotopic Mass | 495.1628 |
| Heavy Atoms | 35 |
| Complexity | 1228.3934 |
Chemical Identifiers
| CAS Number | 799772-65-9 |
|---|---|
| SMILES | CCOC(=O)C1C(C(=C(NC1=O)SCC(=O)NC2=C(C=C(C=C2C)C)C)C#N)C3=CC=CC=C3F |
Product Overview
AC1MW01S (CAS 799772-65-9), with molecular formula C26H26FN3O4S and molecular weight 495.1628 g/mol. IUPAC: ethyl 5-cyano-4-(2-fluorophenyl)-2-oxo-6-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl-3,4-dihydro-1H-pyridine-3-carboxylate.
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