![2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one structure](/static/products/5676/5676-99-3.webp)
2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one
TL;DR: 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one (CAS 5676-99-3) is a chemical compound with molecular formula C22H16O2S and molecular weight 344.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[(2-phenylmethoxyphenyl)methylidene]-1-benzothiophen-3-one
Also Known As: 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one, (2Z)-2-[(2-phenylmethoxyphenyl)methylidene]-1-benzothiophen-3-one, A1849/0077798, (2Z)-2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one, (2Z)-2-{[2-(BENZYLOXY)PHENYL]METHYLIDENE}-2,3-DIHYDRO-1-BENZOTHIOPHEN-3-ONE
| Molecular Formula | C22H16O2S |
|---|---|
| Molecular Weight | 344.09 g/mol |
| LogP | 5.5951 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.0871 |
| Heavy Atoms | 25 |
| Complexity | 945.00574 |
Chemical Identifiers
| CAS Number | 5676-99-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=CC=C2/C=C\3/C(=O)C4=CC=CC=C4S3 |
Product Overview
2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one (CAS 5676-99-3), with molecular formula C22H16O2S and molecular weight 344.09 g/mol. IUPAC: (2Z)-2-[(2-phenylmethoxyphenyl)methylidene]-1-benzothiophen-3-one.
Chemical Property Profile of 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one
Property Insights of 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one
The XLogP value of 5.5951 indicates that 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one?
The CAS number of 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one is 5676-99-3.
What is the molecular formula of 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one?
The molecular formula of 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one is C22H16O2S.
What is the molecular weight of 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one?
The molecular weight of 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one is 344.09 g/mol.
Where can I buy 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one?
You can request a quote for 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(benzyloxy)benzylidene]-1-benzothiophen-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.