RefChem:261329
TL;DR: RefChem:261329 (CAS 3209-74-3) is a chemical compound with molecular formula C26H33NO7 and molecular weight 471.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-2-oxoacetate;2-pyrrolidin-1-ium-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
Also Known As: alpha-(1-Naphthylmethyl)tetrahydro-2-furanpropionic acid 2-(1-pyrrolidinyl)ethyl ester oxalate, 2-Furanpropionic acid, tetrahydro-alpha-(1-naphthylmethyl)-, 2-(1-pyrrolidinyl)ethyl ester, oxalate (1:1), 2-Hydroxy-2-oxoacetate; 2-pyrrolidin-1-ium-1-ylethyl2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate, 2-FURANPROPIONIC ACID, TETRAHYDRO-alpha-(1-NAPHTHYLMETHYL)-, 2-(1-PYRROLIDINYL)E, 2-hydroxy-2-oxoacetate; 2-pyrrolidin-1-ium-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
| Molecular Formula | C26H33NO7 |
|---|---|
| Molecular Weight | 471.23 g/mol |
| LogP | 0.61 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 471.2257 |
| Heavy Atoms | 34 |
| Complexity | 568.0 |
Chemical Identifiers
| CAS Number | 3209-74-3 |
|---|---|
| SMILES | C1CC[NH+](C1)CCOC(=O)C(CC2CCCO2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)[O-])O |
| InChIKey | YEKGCBWLKULHLL-UHFFFAOYSA-N |
Product Overview
RefChem:261329 (CAS 3209-74-3), with molecular formula C26H33NO7 and molecular weight 471.23 g/mol. IUPAC: 2-hydroxy-2-oxoacetate;2-pyrrolidin-1-ium-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate.
Chemical Property Profile of RefChem:261329
Property Insights of RefChem:261329
The XLogP value of 0.61 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:261329. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:261329. Following Lipinski's Rule of Five, RefChem:261329 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:261329?
The CAS number of RefChem:261329 is 3209-74-3.
What is the molecular formula of RefChem:261329?
The molecular formula of RefChem:261329 is C26H33NO7.
What is the molecular weight of RefChem:261329?
The molecular weight of RefChem:261329 is 471.23 g/mol.
Where can I buy RefChem:261329?
You can request a quote for RefChem:261329 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:261329?
Yes, KEHONG BIO provides custom synthesis services for RefChem:261329 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.