Tetrahydroharmane
TL;DR: Tetrahydroharmane (CAS 2506-10-7) is a chemical compound with molecular formula C12H14N2 and molecular weight 186.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Also Known As: Tetrahydroharman, Methtryptoline, Calligonine, Tetrahydroharmane, Eleagnine
| Molecular Formula | C12H14N2 |
|---|---|
| Molecular Weight | 186.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 27.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.11569 |
| Heavy Atoms | 14 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 2506-10-7 |
|---|---|
| SMILES | CC1C2=C(CCN1)C3=CC=CC=C3N2 |
| InChIKey | LPIJOZBIVDCQTE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetrahydroharmane (CAS 2506-10-7), with molecular formula C12H14N2 and molecular weight 186.12 g/mol. IUPAC: 1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole.
Chemical Property Profile of Tetrahydroharmane
Property Insights of Tetrahydroharmane
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetrahydroharmane. With a topological polar surface area (TPSA) of 27.8 Ų, Tetrahydroharmane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrahydroharmane has 2 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 Tetrahydroharmane?
The CAS number of Tetrahydroharmane is 2506-10-7.
What is the molecular formula of Tetrahydroharmane?
The molecular formula of Tetrahydroharmane is C12H14N2.
What is the molecular weight of Tetrahydroharmane?
The molecular weight of Tetrahydroharmane is 186.12 g/mol.
Where can I buy Tetrahydroharmane?
You can request a quote for Tetrahydroharmane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrahydroharmane?
Yes, KEHONG BIO provides custom synthesis services for Tetrahydroharmane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.