RefChem:315732
TL;DR: RefChem:315732 (CAS 27468-69-5) is a chemical compound with molecular formula C26H39ClN2O5 and molecular weight 494.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(N-[2-(4-butoxyphenoxy)acetyl]-2,5-diethoxyanilino)ethyl-dimethylazanium chloride
Also Known As: Acetanilide, 2-(p-butoxyphenoxy)-N-(2-(dimethylamino)ethyl)-2',5'-diethoxy-, hydrochloride, 2-(p-Butoxyphenoxy)-N-(2-(dimethylamino)ethyl)-2',5'-diethoxyacetanilide hydrochloride, 2-(N-[2-(4-butoxyphenoxy)acetyl]-2,5-diethoxyanilino)ethyl-dimethylazanium chloride, RefChem:315732
| Molecular Formula | C26H39ClN2O5 |
|---|---|
| Molecular Weight | 494.25 g/mol |
| LogP | 0.22 |
| Topological Polar Surface Area | 61.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 494.25476 |
| Heavy Atoms | 34 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 27468-69-5 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)OCC(=O)N(CC[NH+](C)C)C2=C(C=CC(=C2)OCC)OCC.[Cl-] |
| InChIKey | VXEYLPBSVVWNHH-UHFFFAOYSA-N |
Product Overview
RefChem:315732 (CAS 27468-69-5), with molecular formula C26H39ClN2O5 and molecular weight 494.25 g/mol. IUPAC: 2-(N-[2-(4-butoxyphenoxy)acetyl]-2,5-diethoxyanilino)ethyl-dimethylazanium chloride.
Chemical Property Profile of RefChem:315732
Property Insights of RefChem:315732
The XLogP value of 0.22 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:315732. The TPSA of 61.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:315732. Following Lipinski's Rule of Five, RefChem:315732 has 1 hydrogen bond donor(s) and 6 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:315732?
The CAS number of RefChem:315732 is 27468-69-5.
What is the molecular formula of RefChem:315732?
The molecular formula of RefChem:315732 is C26H39ClN2O5.
What is the molecular weight of RefChem:315732?
The molecular weight of RefChem:315732 is 494.25 g/mol.
Where can I buy RefChem:315732?
You can request a quote for RefChem:315732 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:315732?
Yes, KEHONG BIO provides custom synthesis services for RefChem:315732 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.