Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)-
TL;DR: Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)- (CAS 52018-91-4) is a chemical compound with molecular formula C18H19BrN2 and molecular weight 342.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-bromophenyl)-1H-indol-3-yl]butan-2-amine
Also Known As: 3- -2- -1H-indole, 3-(2-Aminobutyl)-2-(p-bromophenyl)indole, 2-(4-Bromophenyl)-alpha-ethyl-1H-indole-3-ethanamine, 1-[2-(4-bromophenyl)-1H-indol-3-yl]butan-2-amine, INDOLE, 3-(2-AMINOBUTYL)-2-(p-BROMOPHENYL)-
| Molecular Formula | C18H19BrN2 |
|---|---|
| Molecular Weight | 342.07 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.07315 |
| Heavy Atoms | 21 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 52018-91-4 |
|---|---|
| SMILES | CCC(CC1=C(NC2=CC=CC=C21)C3=CC=C(C=C3)Br)N |
| InChIKey | VBQVMSNFCANGNB-UHFFFAOYSA-N |
Product Overview
Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)- (CAS 52018-91-4), with molecular formula C18H19BrN2 and molecular weight 342.07 g/mol. IUPAC: 1-[2-(4-bromophenyl)-1H-indol-3-yl]butan-2-amine.
Chemical Property Profile of Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)-
Property Insights of Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)-
The XLogP value of 4.7 indicates that Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.8 Ų, Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)- 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 Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)-?
The CAS number of Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)- is 52018-91-4.
What is the molecular formula of Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)-?
The molecular formula of Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)- is C18H19BrN2.
What is the molecular weight of Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)-?
The molecular weight of Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)- is 342.07 g/mol.
Where can I buy Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)-?
You can request a quote for Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Indole, 3-(2-aminobutyl)-2-(p-bromophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.