2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile
TL;DR: 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile (CAS 1139-76-0) is a chemical compound with molecular formula C12H10N4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile
Also Known As: BIM-0014725.P001, 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile, (3-cyano-4,5,6-trimethyl-2(1H)-pyridinylidene)malononitrile, (3-cyano-4,5,6-trimethylpyridin-2(1H)-ylidene)propanedinitrile, 1,2-Dihydro-2-(dicyan-methylen)-3-cyan-4,5,6-trimethyl-pyridin
| Molecular Formula | C12H10N4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 2.02484 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 210.09055 |
| Heavy Atoms | 16 |
| Complexity | 537.2969 |
Chemical Identifiers
| CAS Number | 1139-76-0 |
|---|---|
| SMILES | CC1=C(NC(=C(C#N)C#N)C(=C1C)C#N)C |
Product Overview
2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile (CAS 1139-76-0), with molecular formula C12H10N4 and molecular weight 210.09 g/mol. IUPAC: 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile.
Chemical Property Profile of 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile
Property Insights of 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile
The XLogP value of 2.02484 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile. Following Lipinski's Rule of Five, 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile has 1 hydrogen bond donor(s) and 4 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-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile?
The CAS number of 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile is 1139-76-0.
What is the molecular formula of 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile?
The molecular formula of 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile is C12H10N4.
What is the molecular weight of 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile?
The molecular weight of 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile is 210.09 g/mol.
Where can I buy 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile?
You can request a quote for 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.