AC1O48UZ
(8S,8aR)-6-amino-8-(3-ethoxy-4-propan-2-yloxyphenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
Also Known As: AM-807/12740122|(8S,8aR)-6-amino-8-(3-ethoxy-4-isopropoxyphenyl)-2-methyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile|(8S,8aR)-6-amino-8-(3-ethoxy-4-propan-2-yloxyphenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile|6-amino-8-(3-ethoxy-4-isopropoxyphenyl)-2-methyl-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile
| Molecular Formula | C24H27N5O2 |
|---|---|
| Molecular Weight | 417.21646 g/mol |
| LogP | 3.22764 |
| Topological Polar Surface Area | 119.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.21646 |
| Monoisotopic Mass | 417.21646 |
| Heavy Atoms | 31 |
| Complexity | 1037.1987 |
Chemical Identifiers
| CAS Number | 494792-08-4 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)[C@@H]2[C@H]3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C)OC(C)C |
Product Overview
AC1O48UZ (CAS 494792-08-4), with molecular formula C24H27N5O2 and molecular weight 417.21646 g/mol. IUPAC: (8S,8aR)-6-amino-8-(3-ethoxy-4-propan-2-yloxyphenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile.
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