2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide
TL;DR: 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide (CAS 6168-85-0) is a chemical compound with molecular formula C13H7ClFIN2O3 and molecular weight 419.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide
Also Known As: 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide, BIM-0008116.P001, AB00103292-01, 2-Chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzene-1-carboximidic acid
| Molecular Formula | C13H7ClFIN2O3 |
|---|---|
| Molecular Weight | 419.92 g/mol |
| LogP | 4.2442 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.9174 |
| Heavy Atoms | 21 |
| Complexity | 739.35144 |
Chemical Identifiers
| CAS Number | 6168-85-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)C2=C(C=CC(=C2)I)Cl)[N+](=O)[O-])F |
Product Overview
2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide (CAS 6168-85-0), with molecular formula C13H7ClFIN2O3 and molecular weight 419.92 g/mol. IUPAC: 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide.
Chemical Property Profile of 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide
Property Insights of 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide
The XLogP value of 4.2442 indicates that 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide. Following Lipinski's Rule of Five, 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide has 1 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-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide?
The CAS number of 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide is 6168-85-0.
What is the molecular formula of 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide?
The molecular formula of 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide is C13H7ClFIN2O3.
What is the molecular weight of 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide?
The molecular weight of 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide is 419.92 g/mol.
Where can I buy 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide?
You can request a quote for 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(4-fluoro-3-nitrophenyl)-5-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.