Lissoclinidine
TL;DR: Lissoclinidine (CAS 496909-77-4) is a chemical compound with molecular formula C20H17N3O2S and molecular weight 363.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(6-oxa-4-thia-9,19-diazapentacyclo[10.7.1.03,7.08,20.013,18]icosa-1,3(7),8,10,12(20),13,15,17-octaen-2-yl)ethyl]acetamide
Also Known As: Lissoclinidine, J1.835.649J, N-[2-[4,5-(Oxymethylenethio)-7H-pyrido[2,3,4-kl]acridine-6-yl]ethyl]acetamide, N-(2-(6-oxa-4-thia-19-aza-9-azoniapentacyclo(10.7.1.03,7.08,20.013,18)icosa-1,3(7),8,10,12(20),13,15,17-octaen-2-yl)ethyl)acetamide;2,2,2-trifluoroacetate, N-(2-(6-oxa-4-thia-9,19-diazapentacyclo(10.7.1.0,.0,.0,)icosa-1,3(7),8,10,12(20),13,15,17-octaen-2-yl)ethyl)ethanimidate
| Molecular Formula | C20H17N3O2S |
|---|---|
| Molecular Weight | 363.10 g/mol |
| LogP | 4.0794 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.10416 |
| Heavy Atoms | 26 |
| Complexity | 1064.596 |
Chemical Identifiers
| CAS Number | 496909-77-4 |
|---|---|
| SMILES | CC(=O)NCCC1=C2C3=C(C=CN=C3C4=C1SCO4)C5=CC=CC=C5N2 |
Product Overview
Lissoclinidine (CAS 496909-77-4), with molecular formula C20H17N3O2S and molecular weight 363.10 g/mol. IUPAC: N-[2-(6-oxa-4-thia-9,19-diazapentacyclo[10.7.1.03,7.08,20.013,18]icosa-1,3(7),8,10,12(20),13,15,17-octaen-2-yl)ethyl]acetamide.
Chemical Property Profile of Lissoclinidine
Property Insights of Lissoclinidine
The XLogP value of 4.0794 indicates that Lissoclinidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.25 Ų falls within the moderate polarity range, balancing permeability and solubility for Lissoclinidine. Following Lipinski's Rule of Five, Lissoclinidine has 2 hydrogen bond donor(s) and 5 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 Lissoclinidine?
The CAS number of Lissoclinidine is 496909-77-4.
What is the molecular formula of Lissoclinidine?
The molecular formula of Lissoclinidine is C20H17N3O2S.
What is the molecular weight of Lissoclinidine?
The molecular weight of Lissoclinidine is 363.10 g/mol.
Where can I buy Lissoclinidine?
You can request a quote for Lissoclinidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lissoclinidine?
Yes, KEHONG BIO provides custom synthesis services for Lissoclinidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.