Cotarnine HCl
TL;DR: Cotarnine HCl (CAS 36647-02-6) is a chemical compound with molecular formula C12H16ClNO4 and molecular weight 273.07678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-ol chloride
Also Known As: Cotarnine HCl, Cotarnine hydrochloride, 2-Chloro-6-nitrobenzonitrile, 5,6,7,8-Tetrahydro-4-methoxy-6-methyl-1,3-dioxolo(4,5-g)isoquinolin-5-ol hydrochloride, 1,3-Dioxolo(4.5-g)isoquinolin-5-ol, 5,6,7,8-tetrahydro-4-methoxy-6-methyl-, hydrochloride
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H16ClNO4 |
| Molecular Weight | 273.07678 g/mol |
| XLogP | -3.51 |
| Topological Polar Surface Area (TPSA) | 52.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.07678 Da |
| Heavy Atoms | 18 |
| Complexity | 288.0 |
| SMILES | C[NH+]1CCC2=CC3=C(C(=C2C1O)OC)OCO3.[Cl-] |
| InChIKey | UONSFNPHCTWRGS-UHFFFAOYSA-N |
Chemical Property Profile of Cotarnine HCl
Property Insights of Cotarnine HCl
The XLogP value of -3.51 indicates that Cotarnine HCl is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.4 Ų, Cotarnine HCl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cotarnine HCl 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
What is the CAS number of Cotarnine HCl?
The CAS number of Cotarnine HCl is 36647-02-6.
What is the molecular formula of Cotarnine HCl?
The molecular formula of Cotarnine HCl is C12H16ClNO4.
What is the molecular weight of Cotarnine HCl?
The molecular weight of Cotarnine HCl is 273.07678 g/mol.
Where can I buy Cotarnine HCl?
You can request a quote for Cotarnine HCl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cotarnine HCl?
Yes, CoreyChem provides custom synthesis services for Cotarnine HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.