2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide
TL;DR: 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide (CAS 894666-82-1) is a chemical compound with molecular formula C13H14ClF2NO2 and molecular weight 289.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide
Also Known As: 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide, 2-chloro-4,5-difluoro-N-[1-(tetrahydrofuran-2-yl)ethyl]benzamide, (2-chloro-4,5-difluorophenyl)-N-(oxolan-2-ylethyl)carboxamide
| Molecular Formula | C13H14ClF2NO2 |
|---|---|
| Molecular Weight | 289.07 g/mol |
| LogP | 2.9155 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.0681 |
| Heavy Atoms | 19 |
| Complexity | 489.7767 |
Chemical Identifiers
| CAS Number | 894666-82-1 |
|---|---|
| SMILES | CC(C1CCCO1)NC(=O)C2=CC(=C(C=C2Cl)F)F |
Product Overview
2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide (CAS 894666-82-1), with molecular formula C13H14ClF2NO2 and molecular weight 289.07 g/mol. IUPAC: 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide.
Chemical Property Profile of 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide
Property Insights of 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide
The XLogP value of 2.9155 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide. With a topological polar surface area (TPSA) of 38.33 Ų, 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide has 1 hydrogen bond donor(s) and 2 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-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide?
The CAS number of 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide is 894666-82-1.
What is the molecular formula of 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide?
The molecular formula of 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide is C13H14ClF2NO2.
What is the molecular weight of 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide?
The molecular weight of 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide is 289.07 g/mol.
Where can I buy 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide?
You can request a quote for 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-4,5-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.