6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole
TL;DR: 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole (CAS 153025-29-7) is a chemical compound with molecular formula C11H12ClN3S and molecular weight 253.04405 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-2-piperazin-1-yl-1,3-benzothiazole
Also Known As: 6-CHLORO-2-PIPERAZINO-1,3-BENZOTHIAZOLE, 6-chloro-2-piperazin-1-yl-1,3-benzothiazole, Maybridge1_008776, 6-chloro-2-(piperazin-1-yl)-1,3-benzothiazole, 2-Piperazino-6-chlorobenzothiazole
Technical Specifications
| Molecular Formula | C11H12ClN3S |
| Molecular Weight | 253.04405 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 56.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.04405 Da |
| Heavy Atoms | 16 |
| Complexity | 247.0 |
| SMILES | C1CN(CCN1)C2=NC3=C(S2)C=C(C=C3)Cl |
| InChIKey | HKQTVOYPBKNRJL-UHFFFAOYSA-N |
Chemical Property Profile of 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole
Property Insights of 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole
The XLogP value of 3.0 indicates that 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.4 Ų, 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole has 1 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 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole?
The CAS number of 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole is 153025-29-7.
What is the molecular formula of 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole?
The molecular formula of 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole is C11H12ClN3S.
What is the molecular weight of 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole?
The molecular weight of 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole is 253.04405 g/mol.
Where can I buy 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole?
You can request a quote for 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole?
Yes, CoreyChem provides custom synthesis services for 6-Chloro-2-(piperazin-1-yl)-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.