1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one
TL;DR: 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one (CAS 353487-39-5) is a chemical compound with molecular formula C11H9BrOS and molecular weight 267.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-bromo-1-benzothiophen-3-yl)propan-1-one
Also Known As: 3-Propanoyl-5-bromo-benzo[b]thiophene, 1-(5-bromo-1-benzothiophen-3-yl)propan-1-one, 1-Propanone,1-(5-bromobenzo[b]thien-3-yl)-, 1-(5-bromo-1-benzothien-3-yl)-1-propanone, 1-(5-Bromo-benzo[b]thiophen-3-yl)-propan-1-one
| Molecular Formula | C11H9BrOS |
|---|---|
| Molecular Weight | 267.96 g/mol |
| LogP | 4.2565 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.95575 |
| Heavy Atoms | 14 |
| Complexity | 486.99323 |
Chemical Identifiers
| CAS Number | 353487-39-5 |
|---|---|
| SMILES | CCC(=O)C1=CSC2=C1C=C(C=C2)Br |
Product Overview
1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one (CAS 353487-39-5), with molecular formula C11H9BrOS and molecular weight 267.96 g/mol. IUPAC: 1-(5-bromo-1-benzothiophen-3-yl)propan-1-one.
Chemical Property Profile of 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one
Property Insights of 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one
The XLogP value of 4.2565 indicates that 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one 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-(5-Bromo-1-benzothiophen-3-yl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one 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-(5-Bromo-1-benzothiophen-3-yl)propan-1-one?
The CAS number of 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one is 353487-39-5.
What is the molecular formula of 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one?
The molecular formula of 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one is C11H9BrOS.
What is the molecular weight of 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one?
The molecular weight of 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one is 267.96 g/mol.
Where can I buy 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one?
You can request a quote for 1-(5-Bromo-1-benzothiophen-3-yl)propan-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-1-benzothiophen-3-yl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Bromo-1-benzothiophen-3-yl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.