RefChem:339801
TL;DR: RefChem:339801 (CAS 60796-47-6) is a chemical compound with molecular formula C24H37NO6 and molecular weight 435.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,2-dimethyl-6-pentylchromen-7-yl)oxyethyl-diethylazanium;2-hydroxy-2-oxoacetate
Also Known As: C22H35NO2.1/2C2H2O4, Ethanamine, 2-((2,2-dimethyl-6-pentyl-2H-1-benzopyran-7-yl)oxy)-N,N-diethyl-, ethanedioate (2:1), 7-(2'-Diethylaminoethoxy)-2,2'-dimethyl-6-n-pentylchromene oxalate, C22-H35-N-O2.1/2C2-H2-O4, 2-((2,2-Dimethyl-6-pentyl-2H-1-benzopyran-7-yl)oxy)-N,N-diethylethanamine ethanedioate (2:1)
| Molecular Formula | C24H37NO6 |
|---|---|
| Molecular Weight | 435.26 g/mol |
| LogP | 1.73 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 435.2621 |
| Heavy Atoms | 31 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 60796-47-6 |
|---|---|
| SMILES | CCCCCC1=C(C=C2C(=C1)C=CC(O2)(C)C)OCC[NH+](CC)CC.C(=O)(C(=O)[O-])O |
| InChIKey | BNCQBCWQLYOGFD-UHFFFAOYSA-N |
Product Overview
RefChem:339801 (CAS 60796-47-6), with molecular formula C24H37NO6 and molecular weight 435.26 g/mol. IUPAC: 2-(2,2-dimethyl-6-pentylchromen-7-yl)oxyethyl-diethylazanium;2-hydroxy-2-oxoacetate.
Chemical Property Profile of RefChem:339801
Property Insights of RefChem:339801
The XLogP value of 1.73 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:339801. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:339801. Following Lipinski's Rule of Five, RefChem:339801 has 2 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:339801?
The CAS number of RefChem:339801 is 60796-47-6.
What is the molecular formula of RefChem:339801?
The molecular formula of RefChem:339801 is C24H37NO6.
What is the molecular weight of RefChem:339801?
The molecular weight of RefChem:339801 is 435.26 g/mol.
Where can I buy RefChem:339801?
You can request a quote for RefChem:339801 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:339801?
Yes, KEHONG BIO provides custom synthesis services for RefChem:339801 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.