![(Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one structure](/static/products/312/312939-16-5.png)
(Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one
TL;DR: (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one (CAS 312939-16-5) is a chemical compound with molecular formula C16H12O2S and molecular weight 268.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[(2-hydroxy-4-methylphenyl)methylidene]-1-benzothiophen-3-one
Also Known As: (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one, (2Z)-2-(2-hydroxy-4-methylbenzylidene)-1-benzothiophen-3(2H)-one, (2Z)-2-[(2-hydroxy-4-methylphenyl)methylidene]-1-benzothiophen-3-one, (2Z)-2-[(2-HYDROXY-4-METHYLPHENYL)METHYLIDENE]-2,3-DIHYDRO-1-BENZOTHIOPHEN-3-ONE
| Molecular Formula | C16H12O2S |
|---|---|
| Molecular Weight | 268.06 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.0558 |
| Heavy Atoms | 19 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 312939-16-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)/C=C\2/C(=O)C3=CC=CC=C3S2)O |
| InChIKey | QMTDMOPAZUGTOP-DHDCSXOGSA-N |
Product Overview
(Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one (CAS 312939-16-5), with molecular formula C16H12O2S and molecular weight 268.06 g/mol. IUPAC: (2Z)-2-[(2-hydroxy-4-methylphenyl)methylidene]-1-benzothiophen-3-one.
Chemical Property Profile of (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one
Property Insights of (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one
The XLogP value of 4.1 indicates that (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one. Following Lipinski's Rule of Five, (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one has 1 hydrogen bond donor(s) and 3 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 (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one?
The CAS number of (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one is 312939-16-5.
What is the molecular formula of (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one?
The molecular formula of (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one is C16H12O2S.
What is the molecular weight of (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one?
The molecular weight of (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one is 268.06 g/mol.
Where can I buy (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one?
You can request a quote for (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-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 (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(2-hydroxy-4-methylbenzylidene)benzo[b]thiophen-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.