AC1MGU1B
ethyl 5-cyano-4-(2-fluorophenyl)-2-oxo-6-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanyl-3,4-dihydro-1H-pyridine-3-carboxylate
Also Known As: ethyl 5-cyano-4-(2-fluorophenyl)-2-oxo-6-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanyl-3,4-dihydro-1H-pyridine-3-carboxylate|ethyl 5-cyano-4-(2-fluorophenyl)-2-oxo-6-((2-oxo-2-((3-(trifluoromethyl)phenyl)amino)ethyl)thio)-1,2,3,4-tetrahydropyridine-3-carboxylate|ethyl 5-cyano-4-(2-fluorophenyl)-2-oxo-6-[(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-1,2,3,4-tetrahydropyridine-3-carboxylate
| Molecular Formula | C24H19F4N3O4S |
|---|---|
| Molecular Weight | 521.1032 g/mol |
| LogP | 4.34428 |
| Topological Polar Surface Area | 108.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 521.1032 |
| Monoisotopic Mass | 521.1032 |
| Heavy Atoms | 36 |
| Complexity | 1256.4081 |
Chemical Identifiers
| CAS Number | 693233-59-9 |
|---|---|
| SMILES | CCOC(=O)C1C(C(=C(NC1=O)SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)C#N)C3=CC=CC=C3F |
Product Overview
AC1MGU1B (CAS 693233-59-9), with molecular formula C24H19F4N3O4S and molecular weight 521.1032 g/mol. IUPAC: ethyl 5-cyano-4-(2-fluorophenyl)-2-oxo-6-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanyl-3,4-dihydro-1H-pyridine-3-carboxylate.