AC1NP7X8
methyl 6-amino-4-[5-[(2-chloro-4-fluorophenoxy)methyl]furan-2-yl]-5-cyano-2-methyl-4H-pyran-3-carboxylate
Also Known As: AK-968/41022952|methyl 6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2-furyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate|methyl 6-amino-4-[5-[(2-chloro-4-fluorophenoxy)methyl]furan-2-yl]-5-cyano-2-methyl-4H-pyran-3-carboxylate|methyl 6-amino-4-(5-((2-chloro-4-fluorophenoxy)methyl)furan-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate|methyl 6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]furan-2-yl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
| Molecular Formula | C20H16ClFN2O5 |
|---|---|
| Molecular Weight | 418.07318 g/mol |
| LogP | 3.90578 |
| Topological Polar Surface Area | 107.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.07318 |
| Monoisotopic Mass | 418.07318 |
| Heavy Atoms | 29 |
| Complexity | 1067.0641 |
Chemical Identifiers
| CAS Number | 445232-11-1 |
|---|---|
| SMILES | CC1=C(C(C(=C(O1)N)C#N)C2=CC=C(O2)COC3=C(C=C(C=C3)F)Cl)C(=O)OC |
Product Overview
AC1NP7X8 (CAS 445232-11-1), with molecular formula C20H16ClFN2O5 and molecular weight 418.07318 g/mol. IUPAC: methyl 6-amino-4-[5-[(2-chloro-4-fluorophenoxy)methyl]furan-2-yl]-5-cyano-2-methyl-4H-pyran-3-carboxylate.