AC1O75D1
(8R,8aR)-6-amino-2-ethyl-8-(2-methoxynaphthalen-1-yl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
Also Known As: BAS 06899741|AM-807/12740384|(8R,8aR)-6-amino-2-ethyl-8-(2-methoxynaphthalen-1-yl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile|6-amino-2-ethyl-8-(2-methoxy-1-naphthyl)-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile|(8R,8aR)-6-amino-2-ethyl-8-(2-methoxynaphthalen-1-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
| Molecular Formula | C25H23N5O |
|---|---|
| Molecular Weight | 409.19025 g/mol |
| LogP | 3.59364 |
| Topological Polar Surface Area | 109.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.19025 |
| Monoisotopic Mass | 409.19025 |
| Heavy Atoms | 31 |
| Complexity | 1223.2615 |
Chemical Identifiers
| CAS Number | 494792-20-0 |
|---|---|
| SMILES | CCN1CC=C2[C@H](C1)[C@H](C(C(=C2C#N)N)(C#N)C#N)C3=C(C=CC4=CC=CC=C43)OC |
Product Overview
AC1O75D1 (CAS 494792-20-0), with molecular formula C25H23N5O and molecular weight 409.19025 g/mol. IUPAC: (8R,8aR)-6-amino-2-ethyl-8-(2-methoxynaphthalen-1-yl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile.
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