RefChem:1061529
TL;DR: RefChem:1061529 (CAS 23771-16-6) is a chemical compound with molecular formula C17H26BrNO4 and molecular weight 387.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]azanium bromide
Also Known As: 2-(Cyclohexylamino)-3',4',5'-trimethoxy-acetophenone hydrobromide, ACETOPHENONE, 2-(CYCLOHEXYLAMINO)-3',4',5'-TRIMETHOXY-, HYDROBROMIDE, cyclohexyl-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]azanium bromide, cyclohexyl-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]azanium,bromide, 2-(Cyclohexylamino)-1-(3,4,5-trimethoxyphenyl)ethan-1-one--hydrogen bromide (1/1)
| Molecular Formula | C17H26BrNO4 |
|---|---|
| Molecular Weight | 387.10 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 387.10452 |
| Heavy Atoms | 23 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 23771-16-6 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)C[NH2+]C2CCCCC2.[Br-] |
| InChIKey | UNYRDDPUXLPSCB-UHFFFAOYSA-N |
Product Overview
RefChem:1061529 (CAS 23771-16-6), with molecular formula C17H26BrNO4 and molecular weight 387.10 g/mol. IUPAC: cyclohexyl-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]azanium bromide.
Chemical Property Profile of RefChem:1061529
Property Insights of RefChem:1061529
The XLogP value of -1.2 indicates that RefChem:1061529 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:1061529. Following Lipinski's Rule of Five, RefChem:1061529 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:1061529?
The CAS number of RefChem:1061529 is 23771-16-6.
What is the molecular formula of RefChem:1061529?
The molecular formula of RefChem:1061529 is C17H26BrNO4.
What is the molecular weight of RefChem:1061529?
The molecular weight of RefChem:1061529 is 387.10 g/mol.
Where can I buy RefChem:1061529?
You can request a quote for RefChem:1061529 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1061529?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1061529 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.