1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone
TL;DR: 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone (CAS 1131-87-9) is a chemical compound with molecular formula C10H7BrOS and molecular weight 253.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-benzothiophen-5-yl)-2-bromoethanone
Also Known As: 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone, 1-(1-benzothiophen-5-yl)-2-bromoethanone, 5-(Bromoacetyl)benzo[b]thiophene, 5-bromoacetylbenzo[b]thiophene, 1-(Benzo[b]thiophen-5-yl)-2-bromoethanone
| Molecular Formula | C10H7BrOS |
|---|---|
| Molecular Weight | 253.94 g/mol |
| LogP | 3.4789 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.9401 |
| Heavy Atoms | 13 |
| Complexity | 446.8764 |
Chemical Identifiers
| CAS Number | 1131-87-9 |
|---|---|
| SMILES | C1=CC2=C(C=CS2)C=C1C(=O)CBr |
Product Overview
1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone (CAS 1131-87-9), with molecular formula C10H7BrOS and molecular weight 253.94 g/mol. IUPAC: 1-(1-benzothiophen-5-yl)-2-bromoethanone.
Chemical Property Profile of 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone
Property Insights of 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone
The XLogP value of 3.4789 indicates that 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone has 0 hydrogen bond donor(s) and 2 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-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone?
The CAS number of 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone is 1131-87-9.
What is the molecular formula of 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone?
The molecular formula of 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone is C10H7BrOS.
What is the molecular weight of 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone?
The molecular weight of 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone is 253.94 g/mol.
Where can I buy 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone?
You can request a quote for 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.