2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid
TL;DR: 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid (CAS 499997-77-2) is a chemical compound with molecular formula C14H15ClFNO3 and molecular weight 299.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-chloro-4-fluorophenyl)carbamoyl]cyclohexane-1-carboxylic acid
Also Known As: 2-((3-chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid, 2-[(3-chloro-4-fluorophenyl)carbamoyl]cyclohexane-1-carboxylic acid, 2-[(3-chloro-4-fluorophenyl)carbamoyl]cyclohexanecarboxylic acid, 2-[N-(3-chloro-4-fluorophenyl)carbamoyl]cyclohexanecarboxylic acid, 2-[(3-chloro-4-fluoro-phenyl)carbamoyl]cyclohexane-1-carboxylic Acid
| Molecular Formula | C14H15ClFNO3 |
|---|---|
| Molecular Weight | 299.07 g/mol |
| LogP | 3.3086 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.07245 |
| Heavy Atoms | 20 |
| Complexity | 535.1503 |
Chemical Identifiers
| CAS Number | 499997-77-2 |
|---|---|
| SMILES | C1CCC(C(C1)C(=O)NC2=CC(=C(C=C2)F)Cl)C(=O)O |
Product Overview
2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid (CAS 499997-77-2), with molecular formula C14H15ClFNO3 and molecular weight 299.07 g/mol. IUPAC: 2-[(3-chloro-4-fluorophenyl)carbamoyl]cyclohexane-1-carboxylic acid.
Chemical Property Profile of 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid
Property Insights of 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid
The XLogP value of 3.3086 indicates that 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid. Following Lipinski's Rule of Five, 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid has 2 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-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid?
The CAS number of 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid is 499997-77-2.
What is the molecular formula of 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid?
The molecular formula of 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid is C14H15ClFNO3.
What is the molecular weight of 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid?
The molecular weight of 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid is 299.07 g/mol.
Where can I buy 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid?
You can request a quote for 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((3-Chloro-4-fluorophenyl)carbamoyl)cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.