![2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile structure](/static/products/4768/4768-40-5.webp)
2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile
TL;DR: 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile (CAS 4768-40-5) is a chemical compound with molecular formula C20H17N3 and molecular weight 299.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile
Also Known As: 2-[3-(4-methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile, [3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-en-1-ylidene]propanedinitrile, 2-[3-(4-methylphenyl)-3-[(4-methylphenyl)amino]prop-2-enylidene]propanedinitrile
| Molecular Formula | C20H17N3 |
|---|---|
| Molecular Weight | 299.14 g/mol |
| LogP | 4.73 |
| Topological Polar Surface Area | 59.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.14224 |
| Heavy Atoms | 23 |
| Complexity | 795.1759 |
Chemical Identifiers
| CAS Number | 4768-40-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=CC=C(C#N)C#N)NC2=CC=C(C=C2)C |
Product Overview
2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile (CAS 4768-40-5), with molecular formula C20H17N3 and molecular weight 299.14 g/mol. IUPAC: 2-[3-(4-methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile.
Chemical Property Profile of 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile
Property Insights of 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile
The XLogP value of 4.73 indicates that 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.61 Ų, 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile has 1 hydrogen bond donor(s) and 3 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-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile?
The CAS number of 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile is 4768-40-5.
What is the molecular formula of 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile?
The molecular formula of 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile is C20H17N3.
What is the molecular weight of 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile?
The molecular weight of 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile is 299.14 g/mol.
Where can I buy 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile?
You can request a quote for 2-[3-(4-Methylanilino)-3-(4-methylphenyl)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-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(4-Methylanilino)-3-(4-methylphenyl)prop-2-enylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.