2-Chloro-4,6-dimethoxy-1,3-benzothiazole
TL;DR: 2-Chloro-4,6-dimethoxy-1,3-benzothiazole (CAS 1023559-29-6) is a chemical compound with molecular formula C9H8ClNO2S and molecular weight 228.99643 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-4,6-dimethoxy-1,3-benzothiazole
Also Known As: 2-Chloro-4,6-dimethoxybenzo[d]thiazole, 2-chloro-4,6-dimethoxy-1,3-benzothiazole, 2-chloro-4,6-dimethoxybenzothiazole, 2-chloro-4,6-dimethoxy-benzothiazole
Technical Specifications
| Molecular Formula | C9H8ClNO2S |
| Molecular Weight | 228.99643 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 59.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.99643 Da |
| Heavy Atoms | 14 |
| Complexity | 207.0 |
| SMILES | COC1=CC(=C2C(=C1)SC(=N2)Cl)OC |
| InChIKey | SLPKOCNNXGCCEK-UHFFFAOYSA-N |
Chemical Property Profile of 2-Chloro-4,6-dimethoxy-1,3-benzothiazole
Property Insights of 2-Chloro-4,6-dimethoxy-1,3-benzothiazole
The XLogP value of 3.3 indicates that 2-Chloro-4,6-dimethoxy-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.6 Ų, 2-Chloro-4,6-dimethoxy-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-4,6-dimethoxy-1,3-benzothiazole has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Chloro-4,6-dimethoxy-1,3-benzothiazole?
The CAS number of 2-Chloro-4,6-dimethoxy-1,3-benzothiazole is 1023559-29-6.
What is the molecular formula of 2-Chloro-4,6-dimethoxy-1,3-benzothiazole?
The molecular formula of 2-Chloro-4,6-dimethoxy-1,3-benzothiazole is C9H8ClNO2S.
What is the molecular weight of 2-Chloro-4,6-dimethoxy-1,3-benzothiazole?
The molecular weight of 2-Chloro-4,6-dimethoxy-1,3-benzothiazole is 228.99643 g/mol.
Where can I buy 2-Chloro-4,6-dimethoxy-1,3-benzothiazole?
You can request a quote for 2-Chloro-4,6-dimethoxy-1,3-benzothiazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Chloro-4,6-dimethoxy-1,3-benzothiazole?
Yes, CoreyChem provides custom synthesis services for 2-Chloro-4,6-dimethoxy-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.