Clorgyline hydrochloride
TL;DR: Clorgyline hydrochloride (CAS 17780-75-5) is a chemical compound with molecular formula C13H16Cl3NO and molecular weight 307.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dichlorophenoxy)-N-methyl-N-prop-2-ynylpropan-1-amine;hydrochloride
Also Known As: CLORGYLINE HYDROCHLORIDE, Clorgyline HCl, CLORGILINE HYDROCHLORIDE, CLORGILINEHYDROCHLORIDE, N-Methyl-N-propargyl-3-(2,4-dichlorophenoxy)propylamine hydrochloride
| Molecular Formula | C13H16Cl3NO |
|---|---|
| Molecular Weight | 307.03 g/mol |
| LogP | 3.75 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 307.02975 |
| Heavy Atoms | 18 |
| Complexity | 263.0 |
| Solubility | 8.7 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 17780-75-5 |
|---|---|
| SMILES | CN(CCCOC1=C(C=C(C=C1)Cl)Cl)CC#C.Cl |
| InChIKey | BBAZDLONIUABKI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Clorgyline hydrochloride (CAS 17780-75-5), with molecular formula C13H16Cl3NO and molecular weight 307.03 g/mol. IUPAC: 3-(2,4-dichlorophenoxy)-N-methyl-N-prop-2-ynylpropan-1-amine;hydrochloride.
Chemical Property Profile of Clorgyline hydrochloride
Property Insights of Clorgyline hydrochloride
The XLogP value of 3.75 indicates that Clorgyline hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Clorgyline hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Clorgyline hydrochloride has 1 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 Clorgyline hydrochloride?
The CAS number of Clorgyline hydrochloride is 17780-75-5.
What is the molecular formula of Clorgyline hydrochloride?
The molecular formula of Clorgyline hydrochloride is C13H16Cl3NO.
What is the molecular weight of Clorgyline hydrochloride?
The molecular weight of Clorgyline hydrochloride is 307.03 g/mol.
Where can I buy Clorgyline hydrochloride?
You can request a quote for Clorgyline hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clorgyline hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Clorgyline hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.