RefChem:316920
TL;DR: RefChem:316920 (CAS 23771-14-4) is a chemical compound with molecular formula C20H26BrNO4 and molecular weight 423.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]-(1-phenylpropan-2-yl)azanium bromide
Also Known As: Acetophenone, 3',4',5'-trimethoxy-2-((alpha-methylphenethyl)amino)-, hydrobromide, 3',4',5'-Trimethoxy-2-((alpha-methylphenethyl)amino)-acetophenone hydrobromide, Acetophenone, 2-((alpha-methylphenethyl)amino)-3',4',5'-trimethoxy-, hydrobromide, [2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]-(1-phenylpropan-2-yl)azanium bromide, RefChem:316920
| Molecular Formula | C20H26BrNO4 |
|---|---|
| Molecular Weight | 423.10 g/mol |
| LogP | -0.91 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 423.10452 |
| Heavy Atoms | 26 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 23771-14-4 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1)[NH2+]CC(=O)C2=CC(=C(C(=C2)OC)OC)OC.[Br-] |
| InChIKey | SHCIZOHWCGLFHY-UHFFFAOYSA-N |
Product Overview
RefChem:316920 (CAS 23771-14-4), with molecular formula C20H26BrNO4 and molecular weight 423.10 g/mol. IUPAC: [2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]-(1-phenylpropan-2-yl)azanium bromide.
Chemical Property Profile of RefChem:316920
Property Insights of RefChem:316920
The XLogP value of -0.91 indicates that RefChem:316920 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:316920. Following Lipinski's Rule of Five, RefChem:316920 has 1 hydrogen bond donor(s) and 5 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 RefChem:316920?
The CAS number of RefChem:316920 is 23771-14-4.
What is the molecular formula of RefChem:316920?
The molecular formula of RefChem:316920 is C20H26BrNO4.
What is the molecular weight of RefChem:316920?
The molecular weight of RefChem:316920 is 423.10 g/mol.
Where can I buy RefChem:316920?
You can request a quote for RefChem:316920 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:316920?
Yes, KEHONG BIO provides custom synthesis services for RefChem:316920 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.