2,5-diphenylpenta-2,4-dienenitrile
TL;DR: 2,5-diphenylpenta-2,4-dienenitrile (CAS 6443-79-4) is a chemical compound with molecular formula C17H13N and molecular weight 231.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diphenylpenta-2,4-dienenitrile
Also Known As: 2,5-diphenylpenta-2,4-dienenitrile, (2E,4E)-2,5-diphenylpenta-2,4-dienenitrile
| Molecular Formula | C17H13N |
|---|---|
| Molecular Weight | 231.10 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.1048 |
| Heavy Atoms | 18 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 6443-79-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC=C(C#N)C2=CC=CC=C2 |
| InChIKey | MEAXDVRKAWCVJF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-diphenylpenta-2,4-dienenitrile (CAS 6443-79-4), with molecular formula C17H13N and molecular weight 231.10 g/mol. IUPAC: 2,5-diphenylpenta-2,4-dienenitrile.
Chemical Property Profile of 2,5-diphenylpenta-2,4-dienenitrile
Property Insights of 2,5-diphenylpenta-2,4-dienenitrile
The XLogP value of 4.3 indicates that 2,5-diphenylpenta-2,4-dienenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 2,5-diphenylpenta-2,4-dienenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-diphenylpenta-2,4-dienenitrile has 0 hydrogen bond donor(s) and 1 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-diphenylpenta-2,4-dienenitrile?
The CAS number of 2,5-diphenylpenta-2,4-dienenitrile is 6443-79-4.
What is the molecular formula of 2,5-diphenylpenta-2,4-dienenitrile?
The molecular formula of 2,5-diphenylpenta-2,4-dienenitrile is C17H13N.
What is the molecular weight of 2,5-diphenylpenta-2,4-dienenitrile?
The molecular weight of 2,5-diphenylpenta-2,4-dienenitrile is 231.10 g/mol.
Where can I buy 2,5-diphenylpenta-2,4-dienenitrile?
You can request a quote for 2,5-diphenylpenta-2,4-dienenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-diphenylpenta-2,4-dienenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,5-diphenylpenta-2,4-dienenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.