氯马斯汀
TL;DR: 氯马斯汀 (CAS 15686-51-8) is a chemical compound with molecular formula C21H26ClNO and molecular weight 343.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯马斯汀
(2R)-2-[2-[(1R)-1-(4-chlorophenyl)-1-phenylethoxy]ethyl]-1-methylpyrrolidine
Also Known As: clemastine, Meclastin, Clemastinum, Mecloprodin, Clemastina
| Molecular Formula | C21H26ClNO |
|---|---|
| Molecular Weight | 343.17 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 343.1703 |
| Heavy Atoms | 24 |
| Complexity | 376.0 |
| Melting Point | 178 |
| Solubility | Soluble (hydrogen fumarate formulation) |
Chemical Identifiers
| CAS Number | 15686-51-8 |
|---|---|
| SMILES | C[C@@](C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCC[C@H]3CCCN3C |
| InChIKey | YNNUSGIPVFPVBX-NHCUHLMSSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氯马斯汀 (CAS 15686-51-8), with molecular formula C21H26ClNO and molecular weight 343.17 g/mol. IUPAC: (2R)-2-[2-[(1R)-1-(4-chlorophenyl)-1-phenylethoxy]ethyl]-1-methylpyrrolidine.
Chemical Property Profile of 氯马斯汀
Property Insights of 氯马斯汀
The XLogP value of 5.0 indicates that 氯马斯汀 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 氯马斯汀 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氯马斯汀 has 0 hydrogen bond donor(s) and 2 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 氯马斯汀?
The CAS number of 氯马斯汀 is 15686-51-8.
What is the molecular formula of 氯马斯汀?
The molecular formula of 氯马斯汀 is C21H26ClNO.
What is the molecular weight of 氯马斯汀?
The molecular weight of 氯马斯汀 is 343.17 g/mol.
Where can I buy 氯马斯汀?
You can request a quote for 氯马斯汀 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯马斯汀?
Yes, KEHONG BIO provides custom synthesis services for 氯马斯汀 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.