1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one
TL;DR: 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one (CAS 501111-57-5) is a chemical compound with molecular formula C10H7BrClNO and molecular weight 270.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-bromo-1H-indol-3-yl)-2-chloroethanone
Also Known As: 1-(5-bromo-1H-indol-3-yl)-2-chloroethanone, 1-(5-Bromo-1H-indol-3-yl)-2-chloroethan-1-one, 5-Brom-3-chloracetylindol, 2-(2-isopropylphenoxy)acetohydrazide, 1-(5-bromo-indol-3-yl)-2-chloro-ethanone
| Molecular Formula | C10H7BrClNO |
|---|---|
| Molecular Weight | 270.94 g/mol |
| LogP | 3.3519 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.93994 |
| Heavy Atoms | 14 |
| Complexity | 491.8277 |
Chemical Identifiers
| CAS Number | 501111-57-5 |
|---|---|
| SMILES | C1=CC2=C(C=C1Br)C(=CN2)C(=O)CCl |
Product Overview
1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one (CAS 501111-57-5), with molecular formula C10H7BrClNO and molecular weight 270.94 g/mol. IUPAC: 1-(5-bromo-1H-indol-3-yl)-2-chloroethanone.
Chemical Property Profile of 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one
Property Insights of 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one
The XLogP value of 3.3519 indicates that 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.86 Ų, 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one has 1 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 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one?
The CAS number of 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one is 501111-57-5.
What is the molecular formula of 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one?
The molecular formula of 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one is C10H7BrClNO.
What is the molecular weight of 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one?
The molecular weight of 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one is 270.94 g/mol.
Where can I buy 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one?
You can request a quote for 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-bromo-1H-indol-3-yl)-2-chloroethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.