2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide
TL;DR: 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide (CAS 431996-46-2) is a chemical compound with molecular formula C14H10ClFN2O3 and molecular weight 308.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide
Also Known As: 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide, AB00119363-01
| Molecular Formula | C14H10ClFN2O3 |
|---|---|
| Molecular Weight | 308.04 g/mol |
| LogP | 3.94802 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.0364 |
| Heavy Atoms | 21 |
| Complexity | 734.15424 |
Chemical Identifiers
| CAS Number | 431996-46-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)Cl |
Product Overview
2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide (CAS 431996-46-2), with molecular formula C14H10ClFN2O3 and molecular weight 308.04 g/mol. IUPAC: 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide.
Chemical Property Profile of 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide
Property Insights of 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide
The XLogP value of 3.94802 indicates that 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide 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-(2-fluoro-5-nitrophenyl)-4-methylbenzamide. Following Lipinski's Rule of Five, 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide 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-(2-fluoro-5-nitrophenyl)-4-methylbenzamide?
The CAS number of 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide is 431996-46-2.
What is the molecular formula of 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide?
The molecular formula of 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide is C14H10ClFN2O3.
What is the molecular weight of 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide?
The molecular weight of 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide is 308.04 g/mol.
Where can I buy 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide?
You can request a quote for 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide 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-(2-fluoro-5-nitrophenyl)-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(2-fluoro-5-nitrophenyl)-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.