N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide
TL;DR: N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide (CAS 438458-74-3) is a chemical compound with molecular formula C14H9N3O2S3 and molecular weight 346.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]pyridine-4-carboxamide
Also Known As: N-(4-OXO-5-(2-THIENYLMETHYLENE)-2-THIOXO-1,3-THIAZOLIDIN-3-YL)ISONICOTINAMIDE, N-[(5Z)-4-oxo-5-(thien-2-ylmethylene)-2-thioxo-1,3-thiazolidin-3-yl]isonicotinamide, 651-578-1, N-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]pyridine-4-carboxamide, RefChem:827878
| Molecular Formula | C14H9N3O2S3 |
|---|---|
| Molecular Weight | 346.99 g/mol |
| LogP | 2.6893 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.9857 |
| Heavy Atoms | 22 |
| Complexity | 756.90497 |
Chemical Identifiers
| CAS Number | 438458-74-3 |
|---|---|
| SMILES | C1=CSC(=C1)/C=C/2\C(=O)N(C(=S)S2)NC(=O)C3=CC=NC=C3 |
Product Overview
N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide (CAS 438458-74-3), with molecular formula C14H9N3O2S3 and molecular weight 346.99 g/mol. IUPAC: N-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]pyridine-4-carboxamide.
Chemical Property Profile of N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide
Property Insights of N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide
The XLogP value of 2.6893 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide. Following Lipinski's Rule of Five, N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide 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 N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide?
The CAS number of N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide is 438458-74-3.
What is the molecular formula of N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide?
The molecular formula of N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide is C14H9N3O2S3.
What is the molecular weight of N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide?
The molecular weight of N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide is 346.99 g/mol.
Where can I buy N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide?
You can request a quote for N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-YL)isonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.