9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline
TL;DR: 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline (CAS 134331-71-8) is a chemical compound with molecular formula C18H18N2 and molecular weight 262.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-benzyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
Also Known As: Fenharmane, Fenharmanum, Fenoharman, Phenoharmane, Benzyltetrahydronorharman
| Molecular Formula | C18H18N2 |
|---|---|
| Molecular Weight | 262.15 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 17.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.147 |
| Heavy Atoms | 20 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 134331-71-8 |
|---|---|
| SMILES | C1CNCC2=C1C3=CC=CC=C3N2CC4=CC=CC=C4 |
| InChIKey | SROMRGBJXFAAJU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline (CAS 134331-71-8), with molecular formula C18H18N2 and molecular weight 262.15 g/mol. IUPAC: 9-benzyl-1,2,3,4-tetrahydropyrido[3,4-b]indole.
Chemical Property Profile of 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline
Property Insights of 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline
The XLogP value of 3.0 indicates that 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.0 Ų, 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline 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 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline?
The CAS number of 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline is 134331-71-8.
What is the molecular formula of 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline?
The molecular formula of 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline is C18H18N2.
What is the molecular weight of 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline?
The molecular weight of 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline is 262.15 g/mol.
Where can I buy 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline?
You can request a quote for 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline?
Yes, KEHONG BIO provides custom synthesis services for 9-Benzyl-2,3,4,9-tetrahydro-1H-beta-carboline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.