2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether
TL;DR: 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether (CAS 65558-24-9) is a chemical compound with molecular formula C15H12ClNOS2 and molecular weight 321.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-chlorophenoxy)ethylsulfanyl]-1,3-benzothiazole
Also Known As: BAS 01063652, 2-[2-(4-chlorophenoxy)ethylsulfanyl]-1,3-benzothiazole, 2-(1,3-benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether, AN-023/12771001, 2-[2-(4-Chloro-phenoxy)-ethylsulfanyl]-benzothiazole
| Molecular Formula | C15H12ClNOS2 |
|---|---|
| Molecular Weight | 321.00 g/mol |
| LogP | 5.1208 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 321.00488 |
| Heavy Atoms | 20 |
| Complexity | 663.4198 |
Chemical Identifiers
| CAS Number | 65558-24-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)SCCOC3=CC=C(C=C3)Cl |
Product Overview
2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether (CAS 65558-24-9), with molecular formula C15H12ClNOS2 and molecular weight 321.00 g/mol. IUPAC: 2-[2-(4-chlorophenoxy)ethylsulfanyl]-1,3-benzothiazole.
Chemical Property Profile of 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether
Property Insights of 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether
The XLogP value of 5.1208 indicates that 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.12 Ų, 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether 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 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether?
The CAS number of 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether is 65558-24-9.
What is the molecular formula of 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether?
The molecular formula of 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether is C15H12ClNOS2.
What is the molecular weight of 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether?
The molecular weight of 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether is 321.00 g/mol.
Where can I buy 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether?
You can request a quote for 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl 4-chlorophenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.