2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile
TL;DR: 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile (CAS 497090-89-8) is a chemical compound with molecular formula C20H14N2O and molecular weight 298.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5,7-dimethyl-2-phenylchromen-4-ylidene)propanedinitrile
Also Known As: 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile, AS-871/43475913, 2-(5,7-dimethyl-2-phenylchromen-4-ylidene)propanedinitrile, (5,7-dimethyl-2-phenylchromen-4-ylidene)methane-1,1-dicarbonitrile
| Molecular Formula | C20H14N2O |
|---|---|
| Molecular Weight | 298.11 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.11063 |
| Heavy Atoms | 23 |
| Complexity | 603.0 |
Chemical Identifiers
| CAS Number | 497090-89-8 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)OC(=CC2=C(C#N)C#N)C3=CC=CC=C3)C |
| InChIKey | IQXDATPOHPHUKD-UHFFFAOYSA-N |
Product Overview
2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile (CAS 497090-89-8), with molecular formula C20H14N2O and molecular weight 298.11 g/mol. IUPAC: 2-(5,7-dimethyl-2-phenylchromen-4-ylidene)propanedinitrile.
Chemical Property Profile of 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile
Property Insights of 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile
The XLogP value of 4.1 indicates that 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile has 0 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-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile?
The CAS number of 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile is 497090-89-8.
What is the molecular formula of 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile?
The molecular formula of 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile is C20H14N2O.
What is the molecular weight of 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile?
The molecular weight of 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile is 298.11 g/mol.
Where can I buy 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile?
You can request a quote for 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(5,7-dimethyl-2-phenyl-4H-chromen-4-ylidene)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.