RefChem:339948
TL;DR: RefChem:339948 (CAS 79592-89-5) is a chemical compound with molecular formula C24H33IN2O4 and molecular weight 540.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3R)-3-(N-benzoyl-2-methoxyanilino)-4-carboxybutyl]-diethyl-methylazanium iodide
Also Known As: 2-(3-(Benzoyl(2-methoxyphenyl)amino)-1-oxopropoxy)-N,N-diethyl-N-methylethanaminium iodide, Ethanaminium, 2-(3-(benzoyl(2-methoxyphenyl)amino)-1-oxopropoxy)-N,N-diethyl-N-methyl-, iodide, [(3R)-3-(N-benzoyl-2-methoxyanilino)-5-hydroxy-5-oxopentyl]-diethyl-methylazanium iodide, RefChem:339948
| Molecular Formula | C24H33IN2O4 |
|---|---|
| Molecular Weight | 540.15 g/mol |
| LogP | 1.0658 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 540.1485 |
| Heavy Atoms | 31 |
| Complexity | 840.4827 |
Chemical Identifiers
| CAS Number | 79592-89-5 |
|---|---|
| SMILES | CC[N+](C)(CC)CC[C@H](CC(=O)O)N(C1=CC=CC=C1OC)C(=O)C2=CC=CC=C2.[I-] |
Product Overview
RefChem:339948 (CAS 79592-89-5), with molecular formula C24H33IN2O4 and molecular weight 540.15 g/mol. IUPAC: [(3R)-3-(N-benzoyl-2-methoxyanilino)-4-carboxybutyl]-diethyl-methylazanium iodide.
Chemical Property Profile of RefChem:339948
Property Insights of RefChem:339948
The XLogP value of 1.0658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:339948. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:339948. Following Lipinski's Rule of Five, RefChem:339948 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:339948?
The CAS number of RefChem:339948 is 79592-89-5.
What is the molecular formula of RefChem:339948?
The molecular formula of RefChem:339948 is C24H33IN2O4.
What is the molecular weight of RefChem:339948?
The molecular weight of RefChem:339948 is 540.15 g/mol.
Where can I buy RefChem:339948?
You can request a quote for RefChem:339948 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:339948?
Yes, KEHONG BIO provides custom synthesis services for RefChem:339948 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.