AC1LR6G9
benzyl (8R,8aR)-6-amino-5,7,7-tricyano-8-(2,4-dichlorophenyl)-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate
Also Known As: AM-807/13104372|benzyl 6-amino-5,7,7-tricyano-8-(2,4-dichlorophenyl)-3,7,8,8a-tetrahydro-2(1H)-isoquinolinecarboxylate|benzyl (8R,8aR)-6-amino-5,7,7-tricyano-8-(2,4-dichlorophenyl)-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate|(8R,8aR)-benzyl 6-amino-5,7,7-tricyano-8-(2,4-dichlorophenyl)-1,7,8,8a-tetrahydroisoquinoline-2(3H)-carboxylate|benzyl (8R,8aR)-6-amino-5,7,7-tricyano-8-(2,4-dichlorophenyl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
| Molecular Formula | C26H19Cl2N5O2 |
|---|---|
| Molecular Weight | 503.09158 g/mol |
| LogP | 5.05554 |
| Topological Polar Surface Area | 126.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 503.09158 |
| Monoisotopic Mass | 503.09158 |
| Heavy Atoms | 35 |
| Complexity | 1350.8365 |
Chemical Identifiers
| CAS Number | 459150-86-8 |
|---|---|
| SMILES | C1C=C2[C@H](CN1C(=O)OCC3=CC=CC=C3)[C@H](C(C(=C2C#N)N)(C#N)C#N)C4=C(C=C(C=C4)Cl)Cl |
Product Overview
AC1LR6G9 (CAS 459150-86-8), with molecular formula C26H19Cl2N5O2 and molecular weight 503.09158 g/mol. IUPAC: benzyl (8R,8aR)-6-amino-5,7,7-tricyano-8-(2,4-dichlorophenyl)-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate.