![3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide structure](/static/products/197/197771-00-9.png)
3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide
TL;DR: 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide (CAS 197771-00-9) is a chemical compound with molecular formula C53H66I4N6S2 and molecular weight 1358.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide
Also Known As: 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide, 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium;tetraiodide, 3-[dimethyl-[5-[4-[(E)-(3-methylbenzothiazol-2-ylidene)methyl]quinolin-1-yl]pentyl]ammonio]propyl-dimethyl-[5-[4-[(E)-(3-methylbenzothiazol-2-ylidene)methyl]quinolin-1-yl]pentyl]azanium tetraiodide, Quinolinium, 1,1'-(1,3-propanediylbis((dimethyliminio)-5,1-pentanediyl))bis(4-((3-methyl-2(3H)-benzothiazolylidene)methyl)-, tetraiodide
| Molecular Formula | C53H66I4N6S2 |
|---|---|
| Molecular Weight | 1358.10 g/mol |
| LogP | -0.7513 |
| Topological Polar Surface Area | 14.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 1358.0969 |
| Heavy Atoms | 65 |
| Complexity | 2387.593 |
Chemical Identifiers
| CAS Number | 197771-00-9 |
|---|---|
| SMILES | CN1/C(=C\C2=CC=[N+](C3=CC=CC=C23)CCCCC[N+](CCC[N+](CCCCC[N+]4=CC=C(C5=CC=CC=C45)/C=C\6/SC7=CC=CC=C7N6C)(C)C)(C)C)/SC8=CC=CC=C18.[I-].[I-].[I-].[I-] |
Product Overview
3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide (CAS 197771-00-9), with molecular formula C53H66I4N6S2 and molecular weight 1358.10 g/mol. IUPAC: 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide.
Chemical Property Profile of 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide
Property Insights of 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide
The XLogP value of -0.7513 indicates that 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 14.24 Ų, 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide?
The CAS number of 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide is 197771-00-9.
What is the molecular formula of 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide?
The molecular formula of 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide is C53H66I4N6S2.
What is the molecular weight of 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide?
The molecular weight of 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide is 1358.10 g/mol.
Where can I buy 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide?
You can request a quote for 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide?
Yes, KEHONG BIO provides custom synthesis services for 3-[dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azaniumyl]propyl-dimethyl-[5-[4-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]quinolin-1-ium-1-yl]pentyl]azanium tetraiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.