(Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide
TL;DR: (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide (CAS 896827-51-3) is a chemical compound with molecular formula C22H16N2O3S3 and molecular weight 452.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-4-phenylmethoxybenzamide
Also Known As: (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide, 4-(benzyloxy)-N-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzamide, N-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-4-phenylmethoxybenzamide
| Molecular Formula | C22H16N2O3S3 |
|---|---|
| Molecular Weight | 452.03 g/mol |
| LogP | 4.8733 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.03232 |
| Heavy Atoms | 30 |
| Complexity | 1094.426 |
Chemical Identifiers
| CAS Number | 896827-51-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NN3C(=O)/C(=C/C4=CC=CS4)/SC3=S |
Product Overview
(Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide (CAS 896827-51-3), with molecular formula C22H16N2O3S3 and molecular weight 452.03 g/mol. IUPAC: N-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-4-phenylmethoxybenzamide.
Chemical Property Profile of (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide
Property Insights of (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide
The XLogP value of 4.8733 indicates that (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide has 1 hydrogen bond donor(s) and 6 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)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide?
The CAS number of (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide is 896827-51-3.
What is the molecular formula of (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide?
The molecular formula of (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide is C22H16N2O3S3.
What is the molecular weight of (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide?
The molecular weight of (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide is 452.03 g/mol.
Where can I buy (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide?
You can request a quote for (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-(benzyloxy)-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.