2-Allylthio-6-amino-3,5-dicyanopyridine
TL;DR: 2-Allylthio-6-amino-3,5-dicyanopyridine (CAS 119022-87-6) is a chemical compound with molecular formula C10H8N4S and molecular weight 216.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-6-prop-2-enylsulfanylpyridine-3,5-dicarbonitrile
Also Known As: 2-allylthio-6-amino-3,5-dicyanopyridine, 2-(allylthio)-6-amino-3,5-pyridinedicarbonitrile, 2-(allylthio)-6-aminopyridine-3,5-dicarbonitrile, 2-(allylsulfanyl)-6-aminopyridine-3,5-dicarbonitrile, 2-amino-6-prop-2-enylsulfanyl-pyridine-3,5-dicarbonitrile
| Molecular Formula | C10H8N4S |
|---|---|
| Molecular Weight | 216.05 g/mol |
| LogP | 1.68526 |
| Topological Polar Surface Area | 86.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.04697 |
| Heavy Atoms | 15 |
| Complexity | 467.53635 |
Chemical Identifiers
| CAS Number | 119022-87-6 |
|---|---|
| SMILES | C=CCSC1=C(C=C(C(=N1)N)C#N)C#N |
Product Overview
2-Allylthio-6-amino-3,5-dicyanopyridine (CAS 119022-87-6), with molecular formula C10H8N4S and molecular weight 216.05 g/mol. IUPAC: 2-amino-6-prop-2-enylsulfanylpyridine-3,5-dicarbonitrile.
Chemical Property Profile of 2-Allylthio-6-amino-3,5-dicyanopyridine
Property Insights of 2-Allylthio-6-amino-3,5-dicyanopyridine
The XLogP value of 1.68526 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Allylthio-6-amino-3,5-dicyanopyridine. The TPSA of 86.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Allylthio-6-amino-3,5-dicyanopyridine. Following Lipinski's Rule of Five, 2-Allylthio-6-amino-3,5-dicyanopyridine has 1 hydrogen bond donor(s) and 5 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 2-Allylthio-6-amino-3,5-dicyanopyridine?
The CAS number of 2-Allylthio-6-amino-3,5-dicyanopyridine is 119022-87-6.
What is the molecular formula of 2-Allylthio-6-amino-3,5-dicyanopyridine?
The molecular formula of 2-Allylthio-6-amino-3,5-dicyanopyridine is C10H8N4S.
What is the molecular weight of 2-Allylthio-6-amino-3,5-dicyanopyridine?
The molecular weight of 2-Allylthio-6-amino-3,5-dicyanopyridine is 216.05 g/mol.
Where can I buy 2-Allylthio-6-amino-3,5-dicyanopyridine?
You can request a quote for 2-Allylthio-6-amino-3,5-dicyanopyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Allylthio-6-amino-3,5-dicyanopyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-Allylthio-6-amino-3,5-dicyanopyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.