3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole
TL;DR: 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole (CAS 55076-20-5) is a chemical compound with molecular formula C14H10ClNO2 and molecular weight 259.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-5-phenyl-1,4,2-dioxazole
Also Known As: 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole, 3- -5-phenyl-1,4,2-dioxazole, 1,4,2-Dioxazole, 3-(4-chlorophenyl)-5-phenyl-, 3-(4-chlorophenyl)-5-phenyl-5H-1,4,2-dioxazole, 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole #
| Molecular Formula | C14H10ClNO2 |
|---|---|
| Molecular Weight | 259.04 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 30.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.04 |
| Heavy Atoms | 18 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 55076-20-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2OC(=NO2)C3=CC=C(C=C3)Cl |
| InChIKey | DUJLEEJBGCRXST-UHFFFAOYSA-N |
Product Overview
3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole (CAS 55076-20-5), with molecular formula C14H10ClNO2 and molecular weight 259.04 g/mol. IUPAC: 3-(4-chlorophenyl)-5-phenyl-1,4,2-dioxazole.
Chemical Property Profile of 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole
Property Insights of 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole
The XLogP value of 4.2 indicates that 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.8 Ų, 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole has 0 hydrogen bond donor(s) and 3 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 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole?
The CAS number of 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole is 55076-20-5.
What is the molecular formula of 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole?
The molecular formula of 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole is C14H10ClNO2.
What is the molecular weight of 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole?
The molecular weight of 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole is 259.04 g/mol.
Where can I buy 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole?
You can request a quote for 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-5-phenyl-1,4,2-dioxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.