苯丙哌林
TL;DR: 苯丙哌林 (CAS 2156-27-6) is a chemical compound with molecular formula C21H27NO and molecular weight 309.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯丙哌林
1-[1-(2-benzylphenoxy)propan-2-yl]piperidine
Also Known As: Benproperine, Cofrel, Pirexyl, benproperina, Benproperinum
| Molecular Formula | C21H27NO |
|---|---|
| Molecular Weight | 309.21 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 309.20926 |
| Heavy Atoms | 23 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 2156-27-6 |
|---|---|
| SMILES | CC(COC1=CC=CC=C1CC2=CC=CC=C2)N3CCCCC3 |
| InChIKey | JTUQXGZRVLWBCR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯丙哌林 (CAS 2156-27-6), with molecular formula C21H27NO and molecular weight 309.21 g/mol. IUPAC: 1-[1-(2-benzylphenoxy)propan-2-yl]piperidine.
Chemical Property Profile of 苯丙哌林
Property Insights of 苯丙哌林
The XLogP value of 5.1 indicates that 苯丙哌林 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 苯丙哌林 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯丙哌林 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 苯丙哌林?
The CAS number of 苯丙哌林 is 2156-27-6.
What is the molecular formula of 苯丙哌林?
The molecular formula of 苯丙哌林 is C21H27NO.
What is the molecular weight of 苯丙哌林?
The molecular weight of 苯丙哌林 is 309.21 g/mol.
Where can I buy 苯丙哌林?
You can request a quote for 苯丙哌林 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯丙哌林?
Yes, KEHONG BIO provides custom synthesis services for 苯丙哌林 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.