Protoberberine
TL;DR: Protoberberine (CAS 19716-69-9) is a chemical compound with molecular formula C17H14N+ and molecular weight 232.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium
Also Known As: Protoberberine, protoberberine iodide, protoberberine hydroxide, 5,6-Dihydrodibenzo(a,g)quinolizinium, 5,6-dihydrodibenzo[a,g]quinolizinium
| Molecular Formula | C17H14N+ |
|---|---|
| Molecular Weight | 232.11 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 232.11263 |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 19716-69-9 |
|---|---|
| SMILES | C1C[N+]2=CC3=CC=CC=C3C=C2C4=CC=CC=C41 |
| InChIKey | UICBHOXXGLYZJH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Protoberberine (CAS 19716-69-9), with molecular formula C17H14N+ and molecular weight 232.11 g/mol. IUPAC: 5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium.
Chemical Property Profile of Protoberberine
Property Insights of Protoberberine
The XLogP value of 3.9 indicates that Protoberberine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.9 Ų, Protoberberine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Protoberberine has 0 hydrogen bond donor(s) and 0 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 Protoberberine?
The CAS number of Protoberberine is 19716-69-9.
What is the molecular formula of Protoberberine?
The molecular formula of Protoberberine is C17H14N+.
What is the molecular weight of Protoberberine?
The molecular weight of Protoberberine is 232.11 g/mol.
Where can I buy Protoberberine?
You can request a quote for Protoberberine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Protoberberine?
Yes, KEHONG BIO provides custom synthesis services for Protoberberine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.