[2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride
TL;DR: [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride (CAS 163679-36-5) is a chemical compound with molecular formula C16H16ClNO3 and molecular weight 305.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-benzoylphenyl)-1-carboxyethyl]azanium chloride
Also Known As: [2-(4-benzoylphenyl)-1-carboxyethyl]azanium;chloride|[2-(4-benzoylphenyl)-1-carboxy-ethyl]azanium Chloride|[3-(4-benzoylphenyl)-1-hydroxy-1-oxopropan-2-yl]azanium chloride
| Molecular Formula | C16H16ClNO3 |
|---|---|
| Molecular Weight | 305.08 g/mol |
| LogP | -1.8408 |
| Topological Polar Surface Area | 82.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.08188 |
| Heavy Atoms | 21 |
| Complexity | 611.179 |
Chemical Identifiers
| CAS Number | 163679-36-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CC(C(=O)O)[NH3+].[Cl-] |
Product Overview
[2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride (CAS 163679-36-5), with molecular formula C16H16ClNO3 and molecular weight 305.08 g/mol. IUPAC: [2-(4-benzoylphenyl)-1-carboxyethyl]azanium chloride.
Chemical Property Profile of [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride
Property Insights of [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride
The XLogP value of -1.8408 indicates that [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.01 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride. Following Lipinski's Rule of Five, [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride 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-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride?
The CAS number of [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride is 163679-36-5.
What is the molecular formula of [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride?
The molecular formula of [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride is C16H16ClNO3.
What is the molecular weight of [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride?
The molecular weight of [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride is 305.08 g/mol.
Where can I buy [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride?
You can request a quote for [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Benzoylphenyl)-1-carboxyethyl]azanium;chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.