![6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide structure](/static/products/1462/14620-24-7.webp)
6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide
TL;DR: 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide (CAS 14620-24-7) is a chemical compound with molecular formula C21H17Br2IN2S2 and molecular weight 645.82446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-methyl-1,3-benzothiazole iodide
Also Known As: 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide
Technical Specifications
| Molecular Formula | C21H17Br2IN2S2 |
| Molecular Weight | 645.82446 g/mol |
| XLogP | 3.91 |
| Topological Polar Surface Area (TPSA) | 60.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 647.8224 Da |
| Heavy Atoms | 28 |
| Complexity | 573.0 |
| SMILES | CN1C2=C(C=C(C=C2)Br)SC1=CC=CC=CC3=[N+](C4=C(S3)C=C(C=C4)Br)C.[I-] |
| InChIKey | MZVHLIKGJDOKIT-UHFFFAOYSA-M |
Chemical Property Profile of 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide
Property Insights of 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide
The XLogP value of 3.91 indicates that 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide. Following Lipinski's Rule of Five, 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide?
The CAS number of 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide is 14620-24-7.
What is the molecular formula of 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide?
The molecular formula of 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide is C21H17Br2IN2S2.
What is the molecular weight of 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide?
The molecular weight of 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide is 645.82446 g/mol.
Where can I buy 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide?
You can request a quote for 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide?
Yes, CoreyChem provides custom synthesis services for 6-Bromo-2-[5-(6-bromo-3-methyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-3-methyl-1,3-benzothiazol-3-ium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.