5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole
TL;DR: 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole (CAS 338750-70-2) is a chemical compound with molecular formula C14H9Cl2NOS and molecular weight 308.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-[(4-chlorophenyl)methylsulfanyl]-1,3-benzoxazole
Also Known As: 5-chloro-2-[(4-chlorobenzyl)sulfanyl]-1,3-benzoxazole, 5-chloro-2-{[(4-chlorophenyl)methyl]sulfanyl}-1,3-benzoxazole, 5B-028, 5-chloro-2-[(4-chlorophenyl)methylsulfanyl]-1,3-benzoxazole, 5-Chloro-2-[[(4-chlorophenyl)methyl]thio]benzoxazole
| Molecular Formula | C14H9Cl2NOS |
|---|---|
| Molecular Weight | 308.98 g/mol |
| LogP | 5.4269 |
| Topological Polar Surface Area | 26.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.97818 |
| Heavy Atoms | 19 |
| Complexity | 709.0427 |
Chemical Identifiers
| CAS Number | 338750-70-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CSC2=NC3=C(O2)C=CC(=C3)Cl)Cl |
Product Overview
5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole (CAS 338750-70-2), with molecular formula C14H9Cl2NOS and molecular weight 308.98 g/mol. IUPAC: 5-chloro-2-[(4-chlorophenyl)methylsulfanyl]-1,3-benzoxazole.
Chemical Property Profile of 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole
Property Insights of 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole
The XLogP value of 5.4269 indicates that 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.03 Ų, 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole 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 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole?
The CAS number of 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole is 338750-70-2.
What is the molecular formula of 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole?
The molecular formula of 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole is C14H9Cl2NOS.
What is the molecular weight of 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole?
The molecular weight of 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole is 308.98 g/mol.
Where can I buy 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole?
You can request a quote for 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-2-(((4-chlorophenyl)methyl)thio)benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.