Arimoclomol
TL;DR: Arimoclomol (CAS 289893-23-8) is a chemical compound with molecular formula C14H20ClN3O3 and molecular weight 313.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2R)-2-hydroxy-3-piperidin-1-ylpropoxy]-1-oxidopyridin-1-ium-3-carboximidoyl chloride
Also Known As: Arimoclomol, Arimoclomolum, Amrioclomol, Arimoclomol [INN], Arimoclomolum [INN-Latin]
| Molecular Formula | C14H20ClN3O3 |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.11932 |
| Heavy Atoms | 21 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 289893-23-8 |
|---|---|
| SMILES | C1CCN(CC1)C[C@H](CON=C(C2=C[N+](=CC=C2)[O-])Cl)O |
| InChIKey | SGEIEGAXKLMUIZ-CYBMUJFWSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Arimoclomol (CAS 289893-23-8), with molecular formula C14H20ClN3O3 and molecular weight 313.12 g/mol. IUPAC: N-[(2R)-2-hydroxy-3-piperidin-1-ylpropoxy]-1-oxidopyridin-1-ium-3-carboximidoyl chloride.
Chemical Property Profile of Arimoclomol
Property Insights of Arimoclomol
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Arimoclomol. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Arimoclomol. Following Lipinski's Rule of Five, Arimoclomol has 1 hydrogen bond donor(s) and 5 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 Arimoclomol?
The CAS number of Arimoclomol is 289893-23-8.
What is the molecular formula of Arimoclomol?
The molecular formula of Arimoclomol is C14H20ClN3O3.
What is the molecular weight of Arimoclomol?
The molecular weight of Arimoclomol is 313.12 g/mol.
Where can I buy Arimoclomol?
You can request a quote for Arimoclomol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Arimoclomol?
Yes, KEHONG BIO provides custom synthesis services for Arimoclomol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.