2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine
TL;DR: 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine (CAS 1079-43-2) is a chemical compound with molecular formula C11H13BrN2 and molecular weight 252.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine
Also Known As: 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine, ZERO/001541, 2-(5-bromo-2-methyl-1H-indol-3-yl)ethan-1-amine, 2-(5-Bromo-2-methylindole-3-yl)ethylamine hydrochloride, 2-Methyl-5-bromo-1H-indole-3-ethanamine
| Molecular Formula | C11H13BrN2 |
|---|---|
| Molecular Weight | 252.03 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.02621 |
| Heavy Atoms | 14 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 1079-43-2 |
|---|---|
| SMILES | CC1=C(C2=C(N1)C=CC(=C2)Br)CCN |
| InChIKey | UPUOXDPQRITUJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine (CAS 1079-43-2), with molecular formula C11H13BrN2 and molecular weight 252.03 g/mol. IUPAC: 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine.
Chemical Property Profile of 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine
Property Insights of 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine. With a topological polar surface area (TPSA) of 41.8 Ų, 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine 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 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine?
The CAS number of 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine is 1079-43-2.
What is the molecular formula of 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine?
The molecular formula of 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine is C11H13BrN2.
What is the molecular weight of 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine?
The molecular weight of 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine is 252.03 g/mol.
Where can I buy 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine?
You can request a quote for 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-bromo-2-methyl-1H-indol-3-yl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.