Tropatepine
TL;DR: Tropatepine (CAS 27574-24-9) is a chemical compound with molecular formula C22H23NS and molecular weight 333.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,5S)-3-(6H-benzo[c][1]benzothiepin-11-ylidene)-8-methyl-8-azabicyclo[3.2.1]octane
Also Known As: Tropatepine, Tropatepina, Tropatepinum, Lepticur, Tropatepine [INN:DCF]
| Molecular Formula | C22H23NS |
|---|---|
| Molecular Weight | 333.16 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 28.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 333.15512 |
| Heavy Atoms | 24 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 27574-24-9 |
|---|---|
| SMILES | CN1[C@H]2CC[C@H]1CC(=C3C4=CC=CC=C4CSC5=CC=CC=C53)C2 |
| InChIKey | JOQKFRLFXDPXHX-ROUUACIJSA-N |
Product Overview
Tropatepine (CAS 27574-24-9), with molecular formula C22H23NS and molecular weight 333.16 g/mol. IUPAC: (1S,5S)-3-(6H-benzo[c][1]benzothiepin-11-ylidene)-8-methyl-8-azabicyclo[3.2.1]octane.
Chemical Property Profile of Tropatepine
Property Insights of Tropatepine
The XLogP value of 4.8 indicates that Tropatepine 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 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tropatepine has 0 hydrogen bond donor(s) and 2 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 Tropatepine?
The CAS number of Tropatepine is 27574-24-9.
What is the molecular formula of Tropatepine?
The molecular formula of Tropatepine is C22H23NS.
What is the molecular weight of Tropatepine?
The molecular weight of Tropatepine is 333.16 g/mol.
Where can I buy Tropatepine?
You can request a quote for Tropatepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tropatepine?
Yes, KEHONG BIO provides custom synthesis services for Tropatepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.