![(2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one structure](/static/products/101/101000-97-9.png)
(2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one
TL;DR: (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one (CAS 101000-97-9) is a chemical compound with molecular formula C15H9BrOS and molecular weight 315.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one
Also Known As: 2-<4-Brom-benzyliden>-thionaphthen-3-on, 2-(4-bromobenzylidene)-1-benzothiophen-3(2H)-one, (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one
| Molecular Formula | C15H9BrOS |
|---|---|
| Molecular Weight | 315.96 g/mol |
| LogP | 4.7786 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 315.95575 |
| Heavy Atoms | 18 |
| Complexity | 643.7981 |
Chemical Identifiers
| CAS Number | 101000-97-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)/C(=C\C3=CC=C(C=C3)Br)/S2 |
Product Overview
(2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one (CAS 101000-97-9), with molecular formula C15H9BrOS and molecular weight 315.96 g/mol. IUPAC: (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one.
Chemical Property Profile of (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one
Property Insights of (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one
The XLogP value of 4.7786 indicates that (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-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, (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-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 (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one?
The CAS number of (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one is 101000-97-9.
What is the molecular formula of (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one?
The molecular formula of (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one is C15H9BrOS.
What is the molecular weight of (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one?
The molecular weight of (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one is 315.96 g/mol.
Where can I buy (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one?
You can request a quote for (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-[(4-bromophenyl)methylidene]-1-benzothiophen-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.