![3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one structure](/static/products/802/80224-53-9.png)
3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one
TL;DR: 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one (CAS 80224-53-9) is a chemical compound with molecular formula C17H11ClOS and molecular weight 298.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-chlorophenyl)methylidene]-5-phenylthiophen-2-one
Also Known As: 3-[(4-chlorophenyl)methylidene]-5-phenylthiophen-2-one, (3Z)-3-[(4-chlorophenyl)methylidene]-5-phenylthiophen-2-one
| Molecular Formula | C17H11ClOS |
|---|---|
| Molecular Weight | 298.02 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.0219 |
| Heavy Atoms | 20 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 80224-53-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=CC3=CC=C(C=C3)Cl)C(=O)S2 |
| InChIKey | DRAVAGAJWOMELD-UHFFFAOYSA-N |
Product Overview
3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one (CAS 80224-53-9), with molecular formula C17H11ClOS and molecular weight 298.02 g/mol. IUPAC: 3-[(4-chlorophenyl)methylidene]-5-phenylthiophen-2-one.
Chemical Property Profile of 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one
Property Insights of 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one
The XLogP value of 5.1 indicates that 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one?
The CAS number of 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one is 80224-53-9.
What is the molecular formula of 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one?
The molecular formula of 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one is C17H11ClOS.
What is the molecular weight of 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one?
The molecular weight of 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one is 298.02 g/mol.
Where can I buy 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one?
You can request a quote for 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Chlorophenyl)methylidene]-5-phenylthiophen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.