AC1MV7IF
5-cyano-6-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxamide
Also Known As: Oprea1_046189|AM-807/13103172|5'-cyano-6'-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-2'-methyl-N-phenyl-1',4'-dihydro-3,4'-bipyridine-3'-carboxamide|5'-cyano-6'-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-2'-methyl-N-phenyl-1',4'-dihydro-[3,4'-bipyridine]-3'-carboxamide|5-cyano-6-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxamide|5-cyano-6-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-2-methyl-N-phenyl-4-(3-pyridinyl)-1,4-dihydro-3-pyridinecarboxamide
| Molecular Formula | C27H22FN5O2S |
|---|---|
| Molecular Weight | 499.14783 g/mol |
| LogP | 4.92728 |
| Topological Polar Surface Area | 106.91 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 499.14783 |
| Monoisotopic Mass | 499.14783 |
| Heavy Atoms | 36 |
| Complexity | 1366.7827 |
Chemical Identifiers
| CAS Number | 354554-95-3 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)F)C#N)C3=CN=CC=C3)C(=O)NC4=CC=CC=C4 |
Product Overview
AC1MV7IF (CAS 354554-95-3), with molecular formula C27H22FN5O2S and molecular weight 499.14783 g/mol. IUPAC: 5-cyano-6-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxamide.
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