![2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile structure](/static/products/1164/1164550-86-0.webp)
2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile
TL;DR: 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile (CAS 1164550-86-0) is a chemical compound with molecular formula C15H13N5 and molecular weight 263.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile
Also Known As: 2-{3-[(4-cyanophenyl)amino]-1-(dimethylamino)prop-2-en-1-ylidene}propanedinitrile, 2-[3-(4-cyanoanilino)-1-(dimethylamino)-2-propenylidene]malononitrile, 2-[3-(4-cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile
| Molecular Formula | C15H13N5 |
|---|---|
| Molecular Weight | 263.12 g/mol |
| LogP | 2.34674 |
| Topological Polar Surface Area | 86.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.1171 |
| Heavy Atoms | 20 |
| Complexity | 629.4799 |
Chemical Identifiers
| CAS Number | 1164550-86-0 |
|---|---|
| SMILES | CN(C)C(=C(C#N)C#N)C=CNC1=CC=C(C=C1)C#N |
Product Overview
2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile (CAS 1164550-86-0), with molecular formula C15H13N5 and molecular weight 263.12 g/mol. IUPAC: 2-[3-(4-cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile.
Chemical Property Profile of 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile
Property Insights of 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile
The XLogP value of 2.34674 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile. The TPSA of 86.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile. Following Lipinski's Rule of Five, 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile 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-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile?
The CAS number of 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile is 1164550-86-0.
What is the molecular formula of 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile?
The molecular formula of 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile is C15H13N5.
What is the molecular weight of 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile?
The molecular weight of 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile is 263.12 g/mol.
Where can I buy 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile?
You can request a quote for 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]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-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(4-Cyanoanilino)-1-(dimethylamino)prop-2-enylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.