(Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide
TL;DR: (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide (CAS 461706-88-7) is a chemical compound with molecular formula C15H9N3O4S3 and molecular weight 390.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-N-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]benzamide
Also Known As: (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide, 2-nitro-N-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]benzamide, 2-nitro-N-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzamide
| Molecular Formula | C15H9N3O4S3 |
|---|---|
| Molecular Weight | 390.98 g/mol |
| LogP | 3.2025 |
| Topological Polar Surface Area | 92.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.97552 |
| Heavy Atoms | 25 |
| Complexity | 908.50525 |
Chemical Identifiers
| CAS Number | 461706-88-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NN2C(=O)/C(=C/C3=CC=CS3)/SC2=S)[N+](=O)[O-] |
Product Overview
(Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide (CAS 461706-88-7), with molecular formula C15H9N3O4S3 and molecular weight 390.98 g/mol. IUPAC: 2-nitro-N-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]benzamide.
Chemical Property Profile of (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide
Property Insights of (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide
The XLogP value of 3.2025 indicates that (Z)-2-nitro-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. The TPSA of 92.55 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide. Following Lipinski's Rule of Five, (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide has 1 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 (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide?
The CAS number of (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide is 461706-88-7.
What is the molecular formula of (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide?
The molecular formula of (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide is C15H9N3O4S3.
What is the molecular weight of (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide?
The molecular weight of (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide is 390.98 g/mol.
Where can I buy (Z)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide?
You can request a quote for (Z)-2-nitro-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)-2-nitro-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-nitro-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.