Azatadine
TL;DR: Azatadine (CAS 3964-81-6) is a chemical compound with molecular formula C20H22N2 and molecular weight 290.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methylpiperidin-4-ylidene)-4-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaene
Also Known As: AZATADINE, Azatadina, AzatadineMaleate, Azatadinum, Azatidine
| Molecular Formula | C20H22N2 |
|---|---|
| Molecular Weight | 290.18 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 16.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 290.17828 |
| Heavy Atoms | 22 |
| Complexity | 417.0 |
| Melting Point | 152-154 |
| Solubility | Very soluble |
Chemical Identifiers
| CAS Number | 3964-81-6 |
|---|---|
| SMILES | CN1CCC(=C2C3=CC=CC=C3CCC4=C2N=CC=C4)CC1 |
| InChIKey | SEBMTIQKRHYNIT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Azatadine (CAS 3964-81-6), with molecular formula C20H22N2 and molecular weight 290.18 g/mol. IUPAC: 2-(1-methylpiperidin-4-ylidene)-4-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaene.
Chemical Property Profile of Azatadine
Property Insights of Azatadine
The XLogP value of 3.6 indicates that Azatadine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 16.1 Ų, Azatadine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azatadine 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 Azatadine?
The CAS number of Azatadine is 3964-81-6.
What is the molecular formula of Azatadine?
The molecular formula of Azatadine is C20H22N2.
What is the molecular weight of Azatadine?
The molecular weight of Azatadine is 290.18 g/mol.
Where can I buy Azatadine?
You can request a quote for Azatadine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azatadine?
Yes, KEHONG BIO provides custom synthesis services for Azatadine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.