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(Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one
TL;DR: (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one (CAS 1636116-25-0) is a chemical compound with molecular formula C17H14O3S and molecular weight 298.06638 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2Z)-2-[(2,4-dimethoxyphenyl)methylidene]-1-benzothiophen-3-one
Also Known As: BAS 00883093, (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one, 2-(2,4-Dimethoxy-benzylidene)-benzo[b]thiophen-3-one, (2Z)-2-(2,4-dimethoxybenzylidene)-1-benzothiophen-3(2H)-one, (2Z)-2-[(2,4-dimethoxyphenyl)methylidene]-1-benzothiophen-3-one
Technical Specifications
| Molecular Formula | C17H14O3S |
| Molecular Weight | 298.06638 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 60.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.06638 Da |
| Heavy Atoms | 21 |
| Complexity | 420.0 |
| SMILES | COC1=CC(=C(C=C1)/C=C\2/C(=O)C3=CC=CC=C3S2)OC |
| InChIKey | IQZIGYGAGLPOEG-SXGWCWSVSA-N |
Chemical Property Profile of (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one
Property Insights of (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one
The XLogP value of 4.1 indicates that (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one. Following Lipinski's Rule of Five, (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one?
The CAS number of (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one is 1636116-25-0.
What is the molecular formula of (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one?
The molecular formula of (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one is C17H14O3S.
What is the molecular weight of (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one?
The molecular weight of (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one is 298.06638 g/mol.
Where can I buy (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one?
You can request a quote for (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one?
Yes, CoreyChem provides custom synthesis services for (Z)-2-(2,4-dimethoxybenzylidene)benzo[b]thiophen-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.