![2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole structure](/static/products/866/866136-11-0.png)
2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole
TL;DR: 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole (CAS 866136-11-0) is a chemical compound with molecular formula C20H14ClNOS and molecular weight 351.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[(4-chlorophenoxy)methyl]phenyl]-1,3-benzothiazole
Also Known As: 2-{3-[(4-chlorophenoxy)methyl]phenyl}-1,3-benzothiazole, 8G-406S, 2-[3-[(4-chlorophenoxy)methyl]phenyl]-1,3-benzothiazole, 2-[3-[(4-chlorophenoxy)methyl]phenyl]benzothiazole
| Molecular Formula | C20H14ClNOS |
|---|---|
| Molecular Weight | 351.05 g/mol |
| LogP | 6.1957 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.04846 |
| Heavy Atoms | 24 |
| Complexity | 945.28455 |
Chemical Identifiers
| CAS Number | 866136-11-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C3=CC=CC(=C3)COC4=CC=C(C=C4)Cl |
Product Overview
2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole (CAS 866136-11-0), with molecular formula C20H14ClNOS and molecular weight 351.05 g/mol. IUPAC: 2-[3-[(4-chlorophenoxy)methyl]phenyl]-1,3-benzothiazole.
Chemical Property Profile of 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole
Property Insights of 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole
The XLogP value of 6.1957 indicates that 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole 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-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole?
The CAS number of 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole is 866136-11-0.
What is the molecular formula of 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole?
The molecular formula of 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole is C20H14ClNOS.
What is the molecular weight of 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole?
The molecular weight of 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole is 351.05 g/mol.
Where can I buy 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole?
You can request a quote for 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-{3-[(4-Chlorophenoxy)methyl]phenyl}-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.