![6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile structure](/static/products/300/300587-40-0.png)
6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile
TL;DR: 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile (CAS 300587-40-0) is a chemical compound with molecular formula C22H30N6 and molecular weight 378.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-1',2-di(propan-2-yl)spiro[3,8a-dihydro-1H-isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile
Also Known As: 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile, 6-amino-1',2-di(propan-2-yl)spiro[3,8a-dihydro-1H-isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile, 6-amino-1',2-diisopropyl-2,3-dihydro-1H-spiro[isoquinoline-8,4'-piperidine]-5,7,7(8aH)-tricarbonitrile
| Molecular Formula | C22H30N6 |
|---|---|
| Molecular Weight | 378.25 g/mol |
| LogP | 2.52714 |
| Topological Polar Surface Area | 103.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.2532 |
| Heavy Atoms | 28 |
| Complexity | 806.55896 |
Chemical Identifiers
| CAS Number | 300587-40-0 |
|---|---|
| SMILES | CC(C)N1CCC2(CC1)C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C(C)C |
Product Overview
6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile (CAS 300587-40-0), with molecular formula C22H30N6 and molecular weight 378.25 g/mol. IUPAC: 6-amino-1',2-di(propan-2-yl)spiro[3,8a-dihydro-1H-isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile.
Chemical Property Profile of 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile
Property Insights of 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile
The XLogP value of 2.52714 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile. The TPSA of 103.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile. Following Lipinski's Rule of Five, 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile has 1 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-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile?
The CAS number of 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile is 300587-40-0.
What is the molecular formula of 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile?
The molecular formula of 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile is C22H30N6.
What is the molecular weight of 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile?
The molecular weight of 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile is 378.25 g/mol.
Where can I buy 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile?
You can request a quote for 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-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-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-amino-1',2-di(propan-2-yl)-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.