Higenamine hydrochloride
TL;DR: Higenamine hydrochloride (CAS 12053-66-6) is a chemical compound with molecular formula C16H18ClNO3 and molecular weight 307.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol;hydrochloride
Also Known As: Higenamine hydrochloride, Higenamine HCl, Demethyl, Norcoclaurine hydrochloride, Demethylcoclaurine HCl
| Molecular Formula | C16H18ClNO3 |
|---|---|
| Molecular Weight | 307.10 g/mol |
| LogP | 2.6547 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.09753 |
| Heavy Atoms | 21 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 12053-66-6 |
|---|---|
| SMILES | C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)O.Cl |
| InChIKey | SWWQQSDRUYSMAR-UHFFFAOYSA-N |
Product Overview
Higenamine hydrochloride (CAS 12053-66-6), with molecular formula C16H18ClNO3 and molecular weight 307.10 g/mol. IUPAC: 1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol;hydrochloride.
Chemical Property Profile of Higenamine hydrochloride
Property Insights of Higenamine hydrochloride
The XLogP value of 2.6547 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Higenamine hydrochloride. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Higenamine hydrochloride. Following Lipinski's Rule of Five, Higenamine hydrochloride has 5 hydrogen bond donor(s) and 4 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 Higenamine hydrochloride?
The CAS number of Higenamine hydrochloride is 12053-66-6.
What is the molecular formula of Higenamine hydrochloride?
The molecular formula of Higenamine hydrochloride is C16H18ClNO3.
What is the molecular weight of Higenamine hydrochloride?
The molecular weight of Higenamine hydrochloride is 307.10 g/mol.
Where can I buy Higenamine hydrochloride?
You can request a quote for Higenamine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Higenamine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Higenamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.