McN-A-343
TL;DR: McN-A-343 (CAS 55-45-8) is a chemical compound with molecular formula C14H18Cl2N2O2 and molecular weight 316.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-chlorophenyl)carbamoyloxy]but-2-ynyl-trimethylazanium chloride
Also Known As: McN-A-343, McN-A 343, MCN A-343 chloride, McNA343, McNeil A 343
| Molecular Formula | C14H18Cl2N2O2 |
|---|---|
| Molecular Weight | 316.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.07452 |
| Heavy Atoms | 20 |
| Complexity | 365.0 |
| Solubility | >47.6 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 55-45-8 |
|---|---|
| SMILES | C[N+](C)(C)CC#CCOC(=O)NC1=CC(=CC=C1)Cl.[Cl-] |
| InChIKey | CXFZFEJJLNLOTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
McN-A-343 (CAS 55-45-8), with molecular formula C14H18Cl2N2O2 and molecular weight 316.07 g/mol. IUPAC: 4-[(3-chlorophenyl)carbamoyloxy]but-2-ynyl-trimethylazanium chloride.
Chemical Property Profile of McN-A-343
Property Insights of McN-A-343
The XLogP value of -0.4 indicates that McN-A-343 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.3 Ų, McN-A-343 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, McN-A-343 has 1 hydrogen bond donor(s) and 3 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 McN-A-343?
The CAS number of McN-A-343 is 55-45-8.
What is the molecular formula of McN-A-343?
The molecular formula of McN-A-343 is C14H18Cl2N2O2.
What is the molecular weight of McN-A-343?
The molecular weight of McN-A-343 is 316.07 g/mol.
Where can I buy McN-A-343?
You can request a quote for McN-A-343 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for McN-A-343?
Yes, KEHONG BIO provides custom synthesis services for McN-A-343 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.