2-(2,4-Dichlorophenyl)-1,3-benzoxazole
TL;DR: 2-(2,4-Dichlorophenyl)-1,3-benzoxazole (CAS 3164-11-2) is a chemical compound with molecular formula C13H7Cl2NO and molecular weight 262.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dichlorophenyl)-1,3-benzoxazole
Also Known As: 2-(2,4-Dichlorophenyl)benzoxazole, 2-(2,4-dichlorophenyl)-1,3-benzoxazole, 2-(2,4-Dichloro-phenyl)-benzooxazole, 2-(2,4-dichlorophenyl)benzo[d]oxazole, BAS 00255151
| Molecular Formula | C13H7Cl2NO |
|---|---|
| Molecular Weight | 262.99 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 262.99048 |
| Heavy Atoms | 17 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 3164-11-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)C3=C(C=C(C=C3)Cl)Cl |
| InChIKey | UHLGOZRQHWGNEB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2,4-Dichlorophenyl)-1,3-benzoxazole (CAS 3164-11-2), with molecular formula C13H7Cl2NO and molecular weight 262.99 g/mol. IUPAC: 2-(2,4-dichlorophenyl)-1,3-benzoxazole.
Chemical Property Profile of 2-(2,4-Dichlorophenyl)-1,3-benzoxazole
Property Insights of 2-(2,4-Dichlorophenyl)-1,3-benzoxazole
The XLogP value of 4.7 indicates that 2-(2,4-Dichlorophenyl)-1,3-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 2-(2,4-Dichlorophenyl)-1,3-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4-Dichlorophenyl)-1,3-benzoxazole 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 2-(2,4-Dichlorophenyl)-1,3-benzoxazole?
The CAS number of 2-(2,4-Dichlorophenyl)-1,3-benzoxazole is 3164-11-2.
What is the molecular formula of 2-(2,4-Dichlorophenyl)-1,3-benzoxazole?
The molecular formula of 2-(2,4-Dichlorophenyl)-1,3-benzoxazole is C13H7Cl2NO.
What is the molecular weight of 2-(2,4-Dichlorophenyl)-1,3-benzoxazole?
The molecular weight of 2-(2,4-Dichlorophenyl)-1,3-benzoxazole is 262.99 g/mol.
Where can I buy 2-(2,4-Dichlorophenyl)-1,3-benzoxazole?
You can request a quote for 2-(2,4-Dichlorophenyl)-1,3-benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-Dichlorophenyl)-1,3-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-Dichlorophenyl)-1,3-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.