7N-646S
TL;DR: 7N-646S (CAS 339019-69-1) is a chemical compound with molecular formula C10H7Cl2NO and molecular weight 226.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(chloromethyl)-5-(2-chlorophenyl)-1,2-oxazole
Also Known As: 3-(chloromethyl)-5-(2-chlorophenyl)isoxazole, 3- -5- isoxazole, 3-(chloromethyl)-5-(2-chlorophenyl)-1,2-oxazole, 3-chloromethyl-5-(2-chloro-phenyl)-isoxazole, Isoxazole, 3-(chloromethyl)-5-(2-chlorophenyl)-
| Molecular Formula | C10H7Cl2NO |
|---|---|
| Molecular Weight | 226.99 g/mol |
| LogP | 3.7338 |
| Topological Polar Surface Area | 26.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.99046 |
| Heavy Atoms | 14 |
| Complexity | 439.192 |
Chemical Identifiers
| CAS Number | 339019-69-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=CC(=NO2)CCl)Cl |
Product Overview
7N-646S (CAS 339019-69-1), with molecular formula C10H7Cl2NO and molecular weight 226.99 g/mol. IUPAC: 3-(chloromethyl)-5-(2-chlorophenyl)-1,2-oxazole.
Chemical Property Profile of 7N-646S
Property Insights of 7N-646S
The XLogP value of 3.7338 indicates that 7N-646S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.03 Ų, 7N-646S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7N-646S has 0 hydrogen bond donor(s) and 2 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 7N-646S?
The CAS number of 7N-646S is 339019-69-1.
What is the molecular formula of 7N-646S?
The molecular formula of 7N-646S is C10H7Cl2NO.
What is the molecular weight of 7N-646S?
The molecular weight of 7N-646S is 226.99 g/mol.
Where can I buy 7N-646S?
You can request a quote for 7N-646S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7N-646S?
Yes, KEHONG BIO provides custom synthesis services for 7N-646S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.