beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid
TL;DR: beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid (CAS 332052-62-7) is a chemical compound with molecular formula C16H20FNO3 and molecular weight 293.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(cyclohexanecarbonylamino)-3-(4-fluorophenyl)propanoic acid
Also Known As: beta-[(Cyclohexylcarbonyl)amino]-4-fluorobenzenepropanoic acid, 3-(cyclohexanecarbonylamino)-3-(4-fluorophenyl)propanoic Acid, N-(cyclohexylcarbonyl)-3-(4-fluorophenyl)-beta-alanine, 3-(cyclohexylcarbonylamino)-3-(4-fluorophenyl)propanoic acid, beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid
| Molecular Formula | C16H20FNO3 |
|---|---|
| Molecular Weight | 293.14 g/mol |
| LogP | 3.038 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.14273 |
| Heavy Atoms | 21 |
| Complexity | 494.74847 |
Chemical Identifiers
| CAS Number | 332052-62-7 |
|---|---|
| SMILES | C1CCC(CC1)C(=O)NC(CC(=O)O)C2=CC=C(C=C2)F |
Product Overview
beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid (CAS 332052-62-7), with molecular formula C16H20FNO3 and molecular weight 293.14 g/mol. IUPAC: 3-(cyclohexanecarbonylamino)-3-(4-fluorophenyl)propanoic acid.
Chemical Property Profile of beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid
Property Insights of beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid
The XLogP value of 3.038 indicates that beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic 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 beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid. Following Lipinski's Rule of Five, beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic 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 beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid?
The CAS number of beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid is 332052-62-7.
What is the molecular formula of beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid?
The molecular formula of beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid is C16H20FNO3.
What is the molecular weight of beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid?
The molecular weight of beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid is 293.14 g/mol.
Where can I buy beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid?
You can request a quote for beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for beta-((Cyclohexylcarbonyl)amino)-4-fluorobenzenepropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.