RefChem:261328
TL;DR: RefChem:261328 (CAS 3406-50-6) is a chemical compound with molecular formula C28H35NO7 and molecular weight 497.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[4-[2-(furan-2-ylmethyl)-3-naphthalen-1-ylpropanoyl]oxybutyl]azanium;2-hydroxy-2-oxoacetate
Also Known As: 2-Furanpropionic acid, alpha-(1-naphthylmethyl)-, 4-(diethylamino)butyl ester, oxalate (1:1), alpha-(1-Naphthylmethyl)-2-furanpropionic acid 4-(diethylamino)butyl ester oxalate (1:1), diethyl-[4-[2-(furan-2-ylmethyl)-3-naphthalen-1-ylpropanoyl]oxybutyl]azanium; 2-hydroxy-2-oxoacetate, RefChem:261328
| Molecular Formula | C28H35NO7 |
|---|---|
| Molecular Weight | 497.24 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 497.24136 |
| Heavy Atoms | 36 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 3406-50-6 |
|---|---|
| SMILES | CC[NH+](CC)CCCCOC(=O)C(CC1=CC=CC2=CC=CC=C21)CC3=CC=CO3.C(=O)(C(=O)[O-])O |
| InChIKey | HUFZSVUNGXWTBY-UHFFFAOYSA-N |
Product Overview
RefChem:261328 (CAS 3406-50-6), with molecular formula C28H35NO7 and molecular weight 497.24 g/mol. IUPAC: diethyl-[4-[2-(furan-2-ylmethyl)-3-naphthalen-1-ylpropanoyl]oxybutyl]azanium;2-hydroxy-2-oxoacetate.
Chemical Property Profile of RefChem:261328
Property Insights of RefChem:261328
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:261328. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:261328. Following Lipinski's Rule of Five, RefChem:261328 has 2 hydrogen bond donor(s) and 7 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:261328?
The CAS number of RefChem:261328 is 3406-50-6.
What is the molecular formula of RefChem:261328?
The molecular formula of RefChem:261328 is C28H35NO7.
What is the molecular weight of RefChem:261328?
The molecular weight of RefChem:261328 is 497.24 g/mol.
Where can I buy RefChem:261328?
You can request a quote for RefChem:261328 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:261328?
Yes, KEHONG BIO provides custom synthesis services for RefChem:261328 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.