N-(4-ethynylphenyl)-2,6-difluorobenzamide
TL;DR: N-(4-ethynylphenyl)-2,6-difluorobenzamide (CAS 439095-46-2) is a chemical compound with molecular formula C15H9F2NO and molecular weight 257.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethynylphenyl)-2,6-difluorobenzamide
Also Known As: N-(4-ethynylphenyl)-2,6-difluorobenzamide, N-(4-ethynylphenyl)-2,6-difluorobenzenecarboxamide, N-(4-ethynylphenyl)-2,6-difluoro-benzamide, N-(4-ethynyl-phenyl)-2,6-difluoro-benzamide
| Molecular Formula | C15H9F2NO |
|---|---|
| Molecular Weight | 257.07 g/mol |
| LogP | 3.1984 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.06522 |
| Heavy Atoms | 19 |
| Complexity | 636.58606 |
Chemical Identifiers
| CAS Number | 439095-46-2 |
|---|---|
| SMILES | C#CC1=CC=C(C=C1)NC(=O)C2=C(C=CC=C2F)F |
Product Overview
N-(4-ethynylphenyl)-2,6-difluorobenzamide (CAS 439095-46-2), with molecular formula C15H9F2NO and molecular weight 257.07 g/mol. IUPAC: N-(4-ethynylphenyl)-2,6-difluorobenzamide.
Chemical Property Profile of N-(4-ethynylphenyl)-2,6-difluorobenzamide
Property Insights of N-(4-ethynylphenyl)-2,6-difluorobenzamide
The XLogP value of 3.1984 indicates that N-(4-ethynylphenyl)-2,6-difluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-(4-ethynylphenyl)-2,6-difluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-ethynylphenyl)-2,6-difluorobenzamide has 1 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 N-(4-ethynylphenyl)-2,6-difluorobenzamide?
The CAS number of N-(4-ethynylphenyl)-2,6-difluorobenzamide is 439095-46-2.
What is the molecular formula of N-(4-ethynylphenyl)-2,6-difluorobenzamide?
The molecular formula of N-(4-ethynylphenyl)-2,6-difluorobenzamide is C15H9F2NO.
What is the molecular weight of N-(4-ethynylphenyl)-2,6-difluorobenzamide?
The molecular weight of N-(4-ethynylphenyl)-2,6-difluorobenzamide is 257.07 g/mol.
Where can I buy N-(4-ethynylphenyl)-2,6-difluorobenzamide?
You can request a quote for N-(4-ethynylphenyl)-2,6-difluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-ethynylphenyl)-2,6-difluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-ethynylphenyl)-2,6-difluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.