N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide
TL;DR: N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide (CAS 353302-94-0) is a chemical compound with molecular formula C15H16N6O2S3 and molecular weight 408.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(4-imino-2-sulfanylidene-1,3-thiazolidin-3-yl)amino]-6-methylpyrimidin-2-yl]-4-methylbenzenesulfonamide
Also Known As: N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide, N-[4-[(4-imino-2-sulfanylidene-1,3-thiazolidin-3-yl)amino]-6-methylpyrimidin-2-yl]-4-methylbenzenesulfonamide, N-{4-[(4-imino-2-thioxo-1,3-thiazolidin-3-yl)amino]-6-methylpyrimidin-2-yl}-4-methylbenzenesulfonamide
| Molecular Formula | C15H16N6O2S3 |
|---|---|
| Molecular Weight | 408.05 g/mol |
| LogP | 2.53211 |
| Topological Polar Surface Area | 111.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.04968 |
| Heavy Atoms | 26 |
| Complexity | 959.3763 |
Chemical Identifiers
| CAS Number | 353302-94-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CC(=N2)NN3C(=N)CSC3=S)C |
Product Overview
N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide (CAS 353302-94-0), with molecular formula C15H16N6O2S3 and molecular weight 408.05 g/mol. IUPAC: N-[4-[(4-imino-2-sulfanylidene-1,3-thiazolidin-3-yl)amino]-6-methylpyrimidin-2-yl]-4-methylbenzenesulfonamide.
Chemical Property Profile of N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide
Property Insights of N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide
The XLogP value of 2.53211 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide. The TPSA of 111.07 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide has 3 hydrogen bond donor(s) and 8 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-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide?
The CAS number of N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide is 353302-94-0.
What is the molecular formula of N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide?
The molecular formula of N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide is C15H16N6O2S3.
What is the molecular weight of N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide?
The molecular weight of N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide is 408.05 g/mol.
Where can I buy N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide?
You can request a quote for N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-((4-imino-2-thioxothiazolidin-3-yl)amino)-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.