AC1LJRA6
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-6-methyl-4-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile
Also Known As: Oprea1_839495|2-((2-chloro-6-fluorobenzyl)thio)-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile|2-[(2-chloro-6-fluorobenzyl)sulfanyl]-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile|2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-6-methyl-4-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile|2-[(2-chloro-6-fluorophenyl)methylthio]-6-methyl-4-(2-thienyl)-5,6,7,8-tetrahy dropyridino[3,2-c]pyridine-3-carbonitrile
| Molecular Formula | C21H17ClFN3S2 |
|---|---|
| Molecular Weight | 429.05365 g/mol |
| LogP | 5.75448 |
| Topological Polar Surface Area | 39.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 429.05365 |
| Monoisotopic Mass | 429.05365 |
| Heavy Atoms | 28 |
| Complexity | 1040.248 |
Chemical Identifiers
| CAS Number | 354556-56-2 |
|---|---|
| SMILES | CN1CCC2=C(C1)C(=C(C(=N2)SCC3=C(C=CC=C3Cl)F)C#N)C4=CC=CS4 |
Product Overview
AC1LJRA6 (CAS 354556-56-2), with molecular formula C21H17ClFN3S2 and molecular weight 429.05365 g/mol. IUPAC: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-6-methyl-4-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile.