盐酸噻芬尼
TL;DR: 盐酸噻芬尼 (CAS 548-68-5) is a chemical compound with molecular formula C20H26ClNOS and molecular weight 363.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
盐酸噻芬尼
S-[2-(diethylamino)ethyl] 2,2-diphenylethanethioate;hydrochloride
Also Known As: Thiphenamil hydrochloride, Thiphenamil HCl, Trocinate, Trocinat, Thiphen
| Molecular Formula | C20H26ClNOS |
|---|---|
| Molecular Weight | 363.14 g/mol |
| LogP | 4.84 |
| Topological Polar Surface Area | 45.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 363.14236 |
| Heavy Atoms | 24 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 548-68-5 |
|---|---|
| SMILES | CCN(CC)CCSC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2.Cl |
| InChIKey | MZWKCFGWAWRHDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
盐酸噻芬尼 (CAS 548-68-5), with molecular formula C20H26ClNOS and molecular weight 363.14 g/mol. IUPAC: S-[2-(diethylamino)ethyl] 2,2-diphenylethanethioate;hydrochloride.
Chemical Property Profile of 盐酸噻芬尼
Property Insights of 盐酸噻芬尼
The XLogP value of 4.84 indicates that 盐酸噻芬尼 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.6 Ų, 盐酸噻芬尼 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 盐酸噻芬尼 has 1 hydrogen bond donor(s) and 3 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 盐酸噻芬尼?
The CAS number of 盐酸噻芬尼 is 548-68-5.
What is the molecular formula of 盐酸噻芬尼?
The molecular formula of 盐酸噻芬尼 is C20H26ClNOS.
What is the molecular weight of 盐酸噻芬尼?
The molecular weight of 盐酸噻芬尼 is 363.14 g/mol.
Where can I buy 盐酸噻芬尼?
You can request a quote for 盐酸噻芬尼 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 盐酸噻芬尼?
Yes, KEHONG BIO provides custom synthesis services for 盐酸噻芬尼 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.