特非那定
TL;DR: 特非那定 (CAS 50679-08-8) is a chemical compound with molecular formula C32H41NO2 and molecular weight 471.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
特非那定
1-(4-tert-butylphenyl)-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butan-1-ol
Also Known As: terfenadine, Seldane, Triludan, Ternadin, Teldane
| Molecular Formula | C32H41NO2 |
|---|---|
| Molecular Weight | 471.31 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 471.31372 |
| Heavy Atoms | 35 |
| Complexity | 582.0 |
| Melting Point | 147 |
| Solubility | 0.0963 |
Chemical Identifiers
| CAS Number | 50679-08-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O |
| InChIKey | GUGOEEXESWIERI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
特非那定 (CAS 50679-08-8), with molecular formula C32H41NO2 and molecular weight 471.31 g/mol. IUPAC: 1-(4-tert-butylphenyl)-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butan-1-ol.
Chemical Property Profile of 特非那定
Property Insights of 特非那定
The XLogP value of 6.6 indicates that 特非那定 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, 特非那定 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 特非那定 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 特非那定?
The CAS number of 特非那定 is 50679-08-8.
What is the molecular formula of 特非那定?
The molecular formula of 特非那定 is C32H41NO2.
What is the molecular weight of 特非那定?
The molecular weight of 特非那定 is 471.31 g/mol.
Where can I buy 特非那定?
You can request a quote for 特非那定 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 特非那定?
Yes, KEHONG BIO provides custom synthesis services for 特非那定 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.