Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate
TL;DR: Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate (CAS 66441-11-0) is a chemical compound with molecular formula C18H16ClNO4S and molecular weight 377.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-[(6-chloro-1,3-benzothiazol-2-yl)oxy]phenoxy]propanoate
Also Known As: Taifun, Joker, Fenthiaprop-ethyl, Fenthiaprop-ethyl [ISO], HOE 35609
| Molecular Formula | C18H16ClNO4S |
|---|---|
| Molecular Weight | 377.05 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 85.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 377.04886 |
| Heavy Atoms | 25 |
| Complexity | 455.0 |
Chemical Identifiers
| CAS Number | 66441-11-0 |
|---|---|
| SMILES | CCOC(=O)C(C)OC1=CC=CC(=C1)OC2=NC3=C(S2)C=C(C=C3)Cl |
| InChIKey | MDTRRKVOSSZNCC-UHFFFAOYSA-N |
Product Overview
Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate (CAS 66441-11-0), with molecular formula C18H16ClNO4S and molecular weight 377.05 g/mol. IUPAC: ethyl 2-[3-[(6-chloro-1,3-benzothiazol-2-yl)oxy]phenoxy]propanoate.
Chemical Property Profile of Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate
Property Insights of Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate
The XLogP value of 4.7 indicates that Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate. Following Lipinski's Rule of Five, Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate has 0 hydrogen bond donor(s) and 6 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 Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate?
The CAS number of Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate is 66441-11-0.
What is the molecular formula of Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate?
The molecular formula of Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate is C18H16ClNO4S.
What is the molecular weight of Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate?
The molecular weight of Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate is 377.05 g/mol.
Where can I buy Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate?
You can request a quote for Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.