RefChem:316940
TL;DR: RefChem:316940 (CAS 23026-56-4) is a chemical compound with molecular formula C26H33NO9 and molecular weight 503.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-2-oxoacetate;1-[3-methoxy-4-[4-[3-(2-methoxyphenoxy)pyrrolidin-1-ium-1-yl]butoxy]phenyl]ethanone
Also Known As: Acetophenone, 3'-methoxy-4'-(4-(3-(o-methoxyphenoxy)-1-pyrrolidinyl)butoxy)-, oxalate (1:1), 3'-Methoxy-4'-(4-(3-(o-methoxyphenoxy)-1-pyrrolidinyl)butoxy)-acetophenone oxalate (1:1), 2-hydroxy-2-oxoacetate; 1-[3-methoxy-4-[4-[3-(2-methoxyphenoxy)pyrrolidin-1-ium-1-yl]butoxy]phenyl]ethanone, RefChem:316940
| Molecular Formula | C26H33NO9 |
|---|---|
| Molecular Weight | 503.22 g/mol |
| LogP | 0.62 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 503.21555 |
| Heavy Atoms | 36 |
| Complexity | 594.0 |
Chemical Identifiers
| CAS Number | 23026-56-4 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1)OCCCC[NH+]2CCC(C2)OC3=CC=CC=C3OC)OC.C(=O)(C(=O)[O-])O |
| InChIKey | IYMMECCEMQQENU-UHFFFAOYSA-N |
Product Overview
RefChem:316940 (CAS 23026-56-4), with molecular formula C26H33NO9 and molecular weight 503.22 g/mol. IUPAC: 2-hydroxy-2-oxoacetate;1-[3-methoxy-4-[4-[3-(2-methoxyphenoxy)pyrrolidin-1-ium-1-yl]butoxy]phenyl]ethanone.
Chemical Property Profile of RefChem:316940
Property Insights of RefChem:316940
The XLogP value of 0.62 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:316940. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:316940. Following Lipinski's Rule of Five, RefChem:316940 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:316940?
The CAS number of RefChem:316940 is 23026-56-4.
What is the molecular formula of RefChem:316940?
The molecular formula of RefChem:316940 is C26H33NO9.
What is the molecular weight of RefChem:316940?
The molecular weight of RefChem:316940 is 503.22 g/mol.
Where can I buy RefChem:316940?
You can request a quote for RefChem:316940 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:316940?
Yes, KEHONG BIO provides custom synthesis services for RefChem:316940 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.