![2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile structure](/static/products/3337/333759-97-0.webp)
2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile
TL;DR: 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile (CAS 333759-97-0) is a chemical compound with molecular formula C28H20N2O and molecular weight 400.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile
Also Known As: BAS 00918587, 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile, AE-848/11244024, 2-{[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylene}malononitrile, 2-(2,6-Diphenyl-4-o-tolyl-4H-pyran-3-ylmethylene)-malononitrile
| Molecular Formula | C28H20N2O |
|---|---|
| Molecular Weight | 400.16 g/mol |
| LogP | 6.53478 |
| Topological Polar Surface Area | 56.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.15756 |
| Heavy Atoms | 31 |
| Complexity | 1253.8378 |
Chemical Identifiers
| CAS Number | 333759-97-0 |
|---|---|
| SMILES | CC1=CC=CC=C1C2C=C(OC(=C2C=C(C#N)C#N)C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile (CAS 333759-97-0), with molecular formula C28H20N2O and molecular weight 400.16 g/mol. IUPAC: 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile.
Chemical Property Profile of 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile
Property Insights of 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile
The XLogP value of 6.53478 indicates that 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.81 Ų, 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile?
The CAS number of 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile is 333759-97-0.
What is the molecular formula of 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile?
The molecular formula of 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile is C28H20N2O.
What is the molecular weight of 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile?
The molecular weight of 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile is 400.16 g/mol.
Where can I buy 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile?
You can request a quote for 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[[4-(2-methylphenyl)-2,6-diphenyl-4H-pyran-3-yl]methylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.