3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile
TL;DR: 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile (CAS 148237-18-7) is a chemical compound with molecular formula C14H15BrN2 and molecular weight 290.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromobutyl)-1-methylindole-2-carbonitrile
Also Known As: 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile, 3-(4-BROMOBUTYL)-2-CYANO-1-METHYLINDOLE, 3-(4-BROMOBUTYL)-1-METHYLINDOLE-2-CARBONITRILE, 1H-Indole-2-carbonitrile,3-(4-bromobutyl)-1-methyl-, 3-(4-bromobutyl)-1-methyl-indole-2-carbonitrile
| Molecular Formula | C14H15BrN2 |
|---|---|
| Molecular Weight | 290.04 g/mol |
| LogP | 3.76758 |
| Topological Polar Surface Area | 28.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.04187 |
| Heavy Atoms | 17 |
| Complexity | 563.34125 |
Chemical Identifiers
| CAS Number | 148237-18-7 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=C1C#N)CCCCBr |
Product Overview
3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile (CAS 148237-18-7), with molecular formula C14H15BrN2 and molecular weight 290.04 g/mol. IUPAC: 3-(4-bromobutyl)-1-methylindole-2-carbonitrile.
Chemical Property Profile of 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile
Property Insights of 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile
The XLogP value of 3.76758 indicates that 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.72 Ų, 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile has 0 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 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile?
The CAS number of 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile is 148237-18-7.
What is the molecular formula of 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile?
The molecular formula of 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile is C14H15BrN2.
What is the molecular weight of 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile?
The molecular weight of 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile is 290.04 g/mol.
Where can I buy 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile?
You can request a quote for 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Bromobutyl)-1-methyl-1H-indole-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.