![6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole structure](/static/products/528/528816-32-2.png)
6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
TL;DR: 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CAS 528816-32-2) is a chemical compound with molecular formula C18H14BrF3N2 and molecular weight 394.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-1-[3-(trifluoromethyl)phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Also Known As: 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole, 6-bromo-1-[3-(trifluoromethyl)phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
| Molecular Formula | C18H14BrF3N2 |
|---|---|
| Molecular Weight | 394.03 g/mol |
| LogP | 5.1843 |
| Topological Polar Surface Area | 27.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 394.02924 |
| Heavy Atoms | 24 |
| Complexity | 914.2581 |
Chemical Identifiers
| CAS Number | 528816-32-2 |
|---|---|
| SMILES | C1CNC(C2=C1C3=C(N2)C=CC(=C3)Br)C4=CC(=CC=C4)C(F)(F)F |
Product Overview
6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CAS 528816-32-2), with molecular formula C18H14BrF3N2 and molecular weight 394.03 g/mol. IUPAC: 6-bromo-1-[3-(trifluoromethyl)phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole.
Chemical Property Profile of 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Property Insights of 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
The XLogP value of 5.1843 indicates that 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.82 Ų, 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The CAS number of 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 528816-32-2.
What is the molecular formula of 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The molecular formula of 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is C18H14BrF3N2.
What is the molecular weight of 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The molecular weight of 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 394.03 g/mol.
Where can I buy 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
You can request a quote for 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-1-(3-(trifluoromethyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.