Duloxetine Hydrochloride
TL;DR: Duloxetine Hydrochloride (CAS 136434-34-9) is a chemical compound with molecular formula C18H20ClNOS and molecular weight 333.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-N-methyl-3-naphthalen-1-yloxy-3-thiophen-2-ylpropan-1-amine;hydrochloride
Also Known As: DULOXETINE HYDROCHLORIDE, Duloxetine HCl, Cymbalta, Ariclaim, Xeristar
| Molecular Formula | C18H20ClNOS |
|---|---|
| Molecular Weight | 333.10 g/mol |
| LogP | 5.05 |
| Topological Polar Surface Area | 49.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.0954 |
| Heavy Atoms | 22 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 136434-34-9 |
|---|---|
| SMILES | CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=CC=CC=C32.Cl |
| InChIKey | BFFSMCNJSOPUAY-LMOVPXPDSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Duloxetine Hydrochloride (CAS 136434-34-9), with molecular formula C18H20ClNOS and molecular weight 333.10 g/mol. IUPAC: (3S)-N-methyl-3-naphthalen-1-yloxy-3-thiophen-2-ylpropan-1-amine;hydrochloride.
Chemical Property Profile of Duloxetine Hydrochloride
Property Insights of Duloxetine Hydrochloride
The XLogP value of 5.05 indicates that Duloxetine Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.5 Ų, Duloxetine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Duloxetine Hydrochloride 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 Duloxetine Hydrochloride?
The CAS number of Duloxetine Hydrochloride is 136434-34-9.
What is the molecular formula of Duloxetine Hydrochloride?
The molecular formula of Duloxetine Hydrochloride is C18H20ClNOS.
What is the molecular weight of Duloxetine Hydrochloride?
The molecular weight of Duloxetine Hydrochloride is 333.10 g/mol.
Where can I buy Duloxetine Hydrochloride?
You can request a quote for Duloxetine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Duloxetine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Duloxetine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.