![(Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one structure](/static/products/312/312939-02-9.png)
(Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one
TL;DR: (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one (CAS 312939-02-9) is a chemical compound with molecular formula C17H15NOS and molecular weight 281.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,4-dimethylphenyl)iminomethyl]-1-benzothiophen-3-ol
Also Known As: (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one, 2-[(3,4-dimethylanilino)methylidene]-1-benzothiophen-3-one, (2E)-2-[(3,4-dimethylanilino)methylidene]-1-benzothiophen-3-one, (2Z)-2-[(3,4-dimethylanilino)methylidene]-1-benzothiophen-3-one, (2E)-2-{[(3,4-dimethylphenyl)amino]methylidene}-1-benzothiophen-3(2H)-one
| Molecular Formula | C17H15NOS |
|---|---|
| Molecular Weight | 281.09 g/mol |
| LogP | 4.97434 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.08743 |
| Heavy Atoms | 20 |
| Complexity | 801.8553 |
Chemical Identifiers
| CAS Number | 312939-02-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N=CC2=C(C3=CC=CC=C3S2)O)C |
Product Overview
(Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one (CAS 312939-02-9), with molecular formula C17H15NOS and molecular weight 281.09 g/mol. IUPAC: 2-[(3,4-dimethylphenyl)iminomethyl]-1-benzothiophen-3-ol.
Chemical Property Profile of (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one
Property Insights of (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one
The XLogP value of 4.97434 indicates that (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.59 Ų, (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-2-(((3,4-dimethylphenyl)amino)methylene)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-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one?
The CAS number of (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one is 312939-02-9.
What is the molecular formula of (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one?
The molecular formula of (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one is C17H15NOS.
What is the molecular weight of (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one?
The molecular weight of (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one is 281.09 g/mol.
Where can I buy (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one?
You can request a quote for (Z)-2-(((3,4-dimethylphenyl)amino)methylene)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-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(((3,4-dimethylphenyl)amino)methylene)benzo[b]thiophen-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.