2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile
TL;DR: 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile (CAS 446838-49-9) is a chemical compound with molecular formula C10H5F3N4 and molecular weight 238.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,2,2-trifluoro-1-(pyridin-2-ylamino)ethylidene]propanedinitrile
Also Known As: IFLab1_004711, IDI1_010466, BAS 04881369, F1054-0002, 2-{2,2,2-trifluoro-1-[(pyridin-2-yl)amino]ethylidene}propanedinitrile
| Molecular Formula | C10H5F3N4 |
|---|---|
| Molecular Weight | 238.05 g/mol |
| LogP | 2.35706 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.04663 |
| Heavy Atoms | 17 |
| Complexity | 489.08304 |
Chemical Identifiers
| CAS Number | 446838-49-9 |
|---|---|
| SMILES | C1=CC=NC(=C1)NC(=C(C#N)C#N)C(F)(F)F |
Product Overview
2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile (CAS 446838-49-9), with molecular formula C10H5F3N4 and molecular weight 238.05 g/mol. IUPAC: 2-[2,2,2-trifluoro-1-(pyridin-2-ylamino)ethylidene]propanedinitrile.
Chemical Property Profile of 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile
Property Insights of 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile
The XLogP value of 2.35706 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile. Following Lipinski's Rule of Five, 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile 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-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile?
The CAS number of 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile is 446838-49-9.
What is the molecular formula of 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile?
The molecular formula of 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile is C10H5F3N4.
What is the molecular weight of 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile?
The molecular weight of 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile is 238.05 g/mol.
Where can I buy 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile?
You can request a quote for 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,2,2-Trifluoro-1-(pyridin-2-ylamino)ethylidene)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.