(2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide
TL;DR: (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide (CAS 849918-11-2) is a chemical compound with molecular formula C29H25N3O4S and molecular weight 511.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide
Also Known As: (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide, (E)-2-cyano-2-((E)-5-(3,4-dimethoxybenzylidene)-4-oxo-3-phenylthiazolidin-2-ylidene)-N-(3,4-dimethylphenyl)acetamide
| Molecular Formula | C29H25N3O4S |
|---|---|
| Molecular Weight | 511.16 g/mol |
| LogP | 3.67482 |
| Topological Polar Surface Area | 93.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 511.1566 |
| Heavy Atoms | 37 |
| Complexity | 1695.8973 |
Chemical Identifiers
| CAS Number | 849918-11-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)/C(=C/2\N(C(=O)/C(=C\C3=CC(=C(C=C3)OC)OC)/S2)C4=CC=CC=C4)/C#N)C |
Product Overview
(2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide (CAS 849918-11-2), with molecular formula C29H25N3O4S and molecular weight 511.16 g/mol. IUPAC: (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide.
Chemical Property Profile of (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide
Property Insights of (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide
The XLogP value of 3.67482 indicates that (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.35 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide. Following Lipinski's Rule of Five, (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide?
The CAS number of (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide is 849918-11-2.
What is the molecular formula of (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide?
The molecular formula of (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide is C29H25N3O4S.
What is the molecular weight of (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide?
The molecular weight of (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide is 511.16 g/mol.
Where can I buy (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide?
You can request a quote for (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-cyano-2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,4-dimethylphenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.