Β-咔啉
TL;DR: Β-咔啉 (CAS 244-63-3) is a chemical compound with molecular formula C11H8N2 and molecular weight 168.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Β-咔啉
9H-pyrido[3,4-b]indole
Also Known As: Norharman, 9H-Pyrido[3,4-B]indole, Norharmane, beta-Carboline, Carbazoline
| Molecular Formula | C11H8N2 |
|---|---|
| Molecular Weight | 168.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.06874 |
| Heavy Atoms | 13 |
| Complexity | 193.0 |
| Melting Point | 199 °C |
| Solubility | >25.2 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 244-63-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(N2)C=NC=C3 |
| InChIKey | AIFRHYZBTHREPW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Β-咔啉 (CAS 244-63-3), with molecular formula C11H8N2 and molecular weight 168.07 g/mol. IUPAC: 9H-pyrido[3,4-b]indole.
Chemical Property Profile of Β-咔啉
Property Insights of Β-咔啉
The XLogP value of 3.2 indicates that Β-咔啉 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, Β-咔啉 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Β-咔啉 has 1 hydrogen bond donor(s) and 1 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 Β-咔啉?
The CAS number of Β-咔啉 is 244-63-3.
What is the molecular formula of Β-咔啉?
The molecular formula of Β-咔啉 is C11H8N2.
What is the molecular weight of Β-咔啉?
The molecular weight of Β-咔啉 is 168.07 g/mol.
Where can I buy Β-咔啉?
You can request a quote for Β-咔啉 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Β-咔啉?
Yes, KEHONG BIO provides custom synthesis services for Β-咔啉 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.