西布曲明
TL;DR: 西布曲明 (CAS 106650-56-0) is a chemical compound with molecular formula C17H26ClN and molecular weight 279.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
西布曲明
1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine
Also Known As: sibutramine, Medaria, Meridia, Sibutraminum, Sibutramina
| Molecular Formula | C17H26ClN |
|---|---|
| Molecular Weight | 279.18 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 279.17538 |
| Heavy Atoms | 19 |
| Complexity | 275.0 |
| Melting Point | 191-192 °C |
| Solubility | 2.9 |
Chemical Identifiers
| CAS Number | 106650-56-0 |
|---|---|
| SMILES | CC(C)CC(C1(CCC1)C2=CC=C(C=C2)Cl)N(C)C |
| InChIKey | UNAANXDKBXWMLN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
西布曲明 (CAS 106650-56-0), with molecular formula C17H26ClN and molecular weight 279.18 g/mol. IUPAC: 1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine.
Chemical Property Profile of 西布曲明
Property Insights of 西布曲明
The XLogP value of 5.4 indicates that 西布曲明 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 西布曲明 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 西布曲明 has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 西布曲明?
The CAS number of 西布曲明 is 106650-56-0.
What is the molecular formula of 西布曲明?
The molecular formula of 西布曲明 is C17H26ClN.
What is the molecular weight of 西布曲明?
The molecular weight of 西布曲明 is 279.18 g/mol.
Where can I buy 西布曲明?
You can request a quote for 西布曲明 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 西布曲明?
Yes, KEHONG BIO provides custom synthesis services for 西布曲明 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.