AC1O46X8
(8R,8aR)-6-amino-2-benzyl-8-(2-methoxynaphthalen-1-yl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
Also Known As: AM-807/12740387|6-amino-2-benzyl-8-(2-methoxy-1-naphthyl)-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile|(8R,8aR)-6-amino-2-benzyl-8-(2-methoxynaphthalen-1-yl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile|(8R,8aR)-6-amino-2-benzyl-8-(2-methoxynaphthalen-1-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
| Molecular Formula | C30H25N5O |
|---|---|
| Molecular Weight | 471.2059 g/mol |
| LogP | 4.77394 |
| Topological Polar Surface Area | 109.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 471.2059 |
| Monoisotopic Mass | 471.2059 |
| Heavy Atoms | 36 |
| Complexity | 1502.91 |
Chemical Identifiers
| CAS Number | 494792-23-3 |
|---|---|
| SMILES | COC1=C(C2=CC=CC=C2C=C1)[C@@H]3[C@H]4CN(CC=C4C(=C(C3(C#N)C#N)N)C#N)CC5=CC=CC=C5 |
Product Overview
AC1O46X8 (CAS 494792-23-3), with molecular formula C30H25N5O and molecular weight 471.2059 g/mol. IUPAC: (8R,8aR)-6-amino-2-benzyl-8-(2-methoxynaphthalen-1-yl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile.
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