![6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile structure](/static/products/306/306947-55-7.png)
6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile
TL;DR: 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile (CAS 306947-55-7) is a chemical compound with molecular formula C20H18N6O and molecular weight 358.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6'-amino-2'-methyl-2-oxospiro[1H-indole-3,8'-3,4,4a,8a-tetrahydro-1H-isoquinoline]-5',7',7'-tricarbonitrile
Also Known As: 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile, 6'-amino-2'-methyl-2-oxo-2',3',4',4a'-tetrahydro-1'H-spiro[indoline-3,8'-isoquinoline]-5',7',7'(8a'H)-tricarbonitrile, 6'-amino-2'-methyl-2-oxospiro[1H-indole-3,8'-3,4,4a,8a-tetrahydro-1H-isoquinoline]-5',7',7'-tricarbonitrile
| Molecular Formula | C20H18N6O |
|---|---|
| Molecular Weight | 358.15 g/mol |
| LogP | 1.22794 |
| Topological Polar Surface Area | 129.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 358.1542 |
| Heavy Atoms | 27 |
| Complexity | 992.52386 |
Chemical Identifiers
| CAS Number | 306947-55-7 |
|---|---|
| SMILES | CN1CCC2C(C1)C3(C4=CC=CC=C4NC3=O)C(C(=C2C#N)N)(C#N)C#N |
Product Overview
6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile (CAS 306947-55-7), with molecular formula C20H18N6O and molecular weight 358.15 g/mol. IUPAC: 6'-amino-2'-methyl-2-oxospiro[1H-indole-3,8'-3,4,4a,8a-tetrahydro-1H-isoquinoline]-5',7',7'-tricarbonitrile.
Chemical Property Profile of 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile
Property Insights of 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile
The XLogP value of 1.22794 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile. The TPSA of 129.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile. Following Lipinski's Rule of Five, 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile?
The CAS number of 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile is 306947-55-7.
What is the molecular formula of 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile?
The molecular formula of 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile is C20H18N6O.
What is the molecular weight of 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile?
The molecular weight of 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile is 358.15 g/mol.
Where can I buy 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile?
You can request a quote for 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6'-amino-2'-methyl-2-oxo-1,1',2,2',3',4',4a',8a'-octahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.