![N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide structure](/static/products/866/866154-61-2.png)
N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide
TL;DR: N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide (CAS 866154-61-2) is a chemical compound with molecular formula C15H12N2O5S2 and molecular weight 364.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-acetyl-N-[5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide
Also Known As: N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide, N-Acetyl-N-[5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-2-thioxo-3-thiazolidinyl]acetamide, N-acetyl-N-[5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide, N-Acetyl-N-{5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetamide
| Molecular Formula | C15H12N2O5S2 |
|---|---|
| Molecular Weight | 364.02 g/mol |
| LogP | 1.9265 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 364.01877 |
| Heavy Atoms | 24 |
| Complexity | 791.0542 |
Chemical Identifiers
| CAS Number | 866154-61-2 |
|---|---|
| SMILES | CC(=O)N(C(=O)C)N1C(=O)C(=CC2=CC3=C(C=C2)OCO3)SC1=S |
Product Overview
N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide (CAS 866154-61-2), with molecular formula C15H12N2O5S2 and molecular weight 364.02 g/mol. IUPAC: N-acetyl-N-[5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide.
Chemical Property Profile of N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide
Property Insights of N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide
The XLogP value of 1.9265 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide. Following Lipinski's Rule of Five, N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide has 0 hydrogen bond donor(s) and 7 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 N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide?
The CAS number of N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide is 866154-61-2.
What is the molecular formula of N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide?
The molecular formula of N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide is C15H12N2O5S2.
What is the molecular weight of N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide?
The molecular weight of N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide is 364.02 g/mol.
Where can I buy N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide?
You can request a quote for N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-acetyl-N-{5-[(Z)-1,3-benzodioxol-5-ylmethylidene]-4-oxo-2-thioxo-1,3-thiazolan-3-yl}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.