Thonzylamine Hydrochloride
TL;DR: Thonzylamine Hydrochloride (CAS 63-56-9) is a chemical compound with molecular formula C16H23ClN4O and molecular weight 322.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(4-methoxyphenyl)methyl]-N,N-dimethyl-N'-pyrimidin-2-ylethane-1,2-diamine;hydrochloride
Also Known As: THONZYLAMINE HYDROCHLORIDE, Thonzylamine HCl, Anahist, Novohetramin, Resistab
| Molecular Formula | C16H23ClN4O |
|---|---|
| Molecular Weight | 322.16 g/mol |
| LogP | 2.48 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 322.15604 |
| Heavy Atoms | 22 |
| Complexity | 273.0 |
| Melting Point | 343 to 176.1 °C |
| Solubility | Very soluble (NTP, 1992) |
Chemical Identifiers
| CAS Number | 63-56-9 |
|---|---|
| SMILES | CN(C)CCN(CC1=CC=C(C=C1)OC)C2=NC=CC=N2.Cl |
| InChIKey | HRYJPHOTGFERGT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thonzylamine Hydrochloride (CAS 63-56-9), with molecular formula C16H23ClN4O and molecular weight 322.16 g/mol. IUPAC: N'-[(4-methoxyphenyl)methyl]-N,N-dimethyl-N'-pyrimidin-2-ylethane-1,2-diamine;hydrochloride.
Chemical Property Profile of Thonzylamine Hydrochloride
Property Insights of Thonzylamine Hydrochloride
The XLogP value of 2.48 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thonzylamine Hydrochloride. With a topological polar surface area (TPSA) of 41.5 Ų, Thonzylamine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thonzylamine Hydrochloride has 1 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 Thonzylamine Hydrochloride?
The CAS number of Thonzylamine Hydrochloride is 63-56-9.
What is the molecular formula of Thonzylamine Hydrochloride?
The molecular formula of Thonzylamine Hydrochloride is C16H23ClN4O.
What is the molecular weight of Thonzylamine Hydrochloride?
The molecular weight of Thonzylamine Hydrochloride is 322.16 g/mol.
Where can I buy Thonzylamine Hydrochloride?
You can request a quote for Thonzylamine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thonzylamine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Thonzylamine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.