Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate
TL;DR: Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate (CAS 3726-62-3) is a chemical compound with molecular formula C13H13ClN2O4S2 and molecular weight 360.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2,4-dimethyl-1,3-thiazol-3-ium-3-yl)-2-methyl-1,3-benzothiazole perchlorate
Also Known As: Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate, 2,4-Dimethyl-3-(2-methyl-6-benzothiazolyl)thiazolium perchlorate, 2,4-dimethyl-3-(2-methyl-1,3-benzothiazol-6-yl)-1,3-thiazol-3-ium perchlorate, 6-(2,4-dimethyl-1,3-thiazol-3-ium-3-yl)-2-methyl-1,3-benzothiazole perchlorate
| Molecular Formula | C13H13ClN2O4S2 |
|---|---|
| Molecular Weight | 360.00 g/mol |
| LogP | -1.19624 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 360.00052 |
| Heavy Atoms | 22 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 3726-62-3 |
|---|---|
| SMILES | CC1=CSC(=[N+]1C2=CC3=C(C=C2)N=C(S3)C)C.[O-]Cl(=O)(=O)=O |
| InChIKey | MKBDMGRLUWGSNO-UHFFFAOYSA-M |
Product Overview
Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate (CAS 3726-62-3), with molecular formula C13H13ClN2O4S2 and molecular weight 360.00 g/mol. IUPAC: 6-(2,4-dimethyl-1,3-thiazol-3-ium-3-yl)-2-methyl-1,3-benzothiazole perchlorate.
Chemical Property Profile of Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate
Property Insights of Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate
The XLogP value of -1.19624 indicates that Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 148.0 Ų indicates high polarity, suggesting Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate has 0 hydrogen bond donor(s) and 7 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 Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate?
The CAS number of Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate is 3726-62-3.
What is the molecular formula of Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate?
The molecular formula of Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate is C13H13ClN2O4S2.
What is the molecular weight of Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate?
The molecular weight of Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate is 360.00 g/mol.
Where can I buy Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate?
You can request a quote for Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate?
Yes, KEHONG BIO provides custom synthesis services for Thiazolium, 2,4-dimethyl-3-(2-methyl-6-benzothiazolyl)-, perchlorate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.