Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride
TL;DR: Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride (CAS 80337-68-4) is a chemical compound with molecular formula C15H17ClN4OS4 and molecular weight 432.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[3-[[2-[2-(1,3-thiazol-4-yl)-1,3-thiazol-4-yl]-1,3-thiazole-4-carbonyl]amino]propyl]sulfanium chloride
Also Known As: Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride, Sulfonium, dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)-, chloride, dimethyl-[3-[[2-[2-(1,3-thiazol-4-yl)-1,3-thiazol-4-yl]-1,3-, Sulfonium, dimethyl[3-[([2,4':2',4''-terthiazol]-4-ylcarbonyl)amino]propyl]-, chloride, dimethyl-[3-[[2-[2-(1,3-thiazol-4-yl)-1,3-thiazol-4-yl]-1,3-thiazole-4-carbonyl]amino]propyl]sulfanium chloride
| Molecular Formula | C15H17ClN4OS4 |
|---|---|
| Molecular Weight | 432.00 g/mol |
| LogP | 0.3919 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.99738 |
| Heavy Atoms | 25 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 80337-68-4 |
|---|---|
| SMILES | C[S+](C)CCCNC(=O)C1=CSC(=N1)C2=CSC(=N2)C3=CSC=N3.[Cl-] |
| InChIKey | BLYJTLPSBWBNJY-UHFFFAOYSA-N |
Product Overview
Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride (CAS 80337-68-4), with molecular formula C15H17ClN4OS4 and molecular weight 432.00 g/mol. IUPAC: dimethyl-[3-[[2-[2-(1,3-thiazol-4-yl)-1,3-thiazol-4-yl]-1,3-thiazole-4-carbonyl]amino]propyl]sulfanium chloride.
Chemical Property Profile of Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride
Property Insights of Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride
The XLogP value of 0.3919 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride. The TPSA of 153.0 Ų indicates high polarity, suggesting Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride has 1 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 Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride?
The CAS number of Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride is 80337-68-4.
What is the molecular formula of Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride?
The molecular formula of Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride is C15H17ClN4OS4.
What is the molecular weight of Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride?
The molecular weight of Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride is 432.00 g/mol.
Where can I buy Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride?
You can request a quote for Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl(3-(((2,4':2',4''-terthiazol)-4-ylcarbonyl)amino)propyl)sulfonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.