Tropatepine hydrochloride
TL;DR: Tropatepine hydrochloride (CAS 27574-25-0) is a chemical compound with molecular formula C22H24ClNS and molecular weight 369.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(6H-benzo[c][1]benzothiepin-11-ylidene)-8-methyl-8-azabicyclo[3.2.1]octane;hydrochloride
Also Known As: Tropatepine hydrochloride, Lepticur (TN), 3-Dibenzo(b,e)thiepin-11(6H)-ylidenetropane hydrochloride, 1-alpha-H,5-alpha-H-Tropane, 3-dibenzo(b,e)thiepin-11(6H)-ylidene-, hydrochloride, 3-Dibenzo(b,e)thiepin-11(6H)-ylidene-8-methyl-8-azabicyclo(3.2.1)octane hydrochloride
| Molecular Formula | C22H24ClNS |
|---|---|
| Molecular Weight | 369.13 g/mol |
| LogP | 5.7726 |
| Topological Polar Surface Area | 28.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 369.1318 |
| Heavy Atoms | 25 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 27574-25-0 |
|---|---|
| SMILES | CN1C2CCC1CC(=C3C4=CC=CC=C4CSC5=CC=CC=C53)C2.Cl |
| InChIKey | LVASURLUIYTDHW-UHFFFAOYSA-N |
Product Overview
Tropatepine hydrochloride (CAS 27574-25-0), with molecular formula C22H24ClNS and molecular weight 369.13 g/mol. IUPAC: 3-(6H-benzo[c][1]benzothiepin-11-ylidene)-8-methyl-8-azabicyclo[3.2.1]octane;hydrochloride.
Chemical Property Profile of Tropatepine hydrochloride
Property Insights of Tropatepine hydrochloride
The XLogP value of 5.7726 indicates that Tropatepine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.5 Ų, Tropatepine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tropatepine hydrochloride has 1 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 Tropatepine hydrochloride?
The CAS number of Tropatepine hydrochloride is 27574-25-0.
What is the molecular formula of Tropatepine hydrochloride?
The molecular formula of Tropatepine hydrochloride is C22H24ClNS.
What is the molecular weight of Tropatepine hydrochloride?
The molecular weight of Tropatepine hydrochloride is 369.13 g/mol.
Where can I buy Tropatepine hydrochloride?
You can request a quote for Tropatepine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tropatepine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Tropatepine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.