2-Bromomethyl-4,5-diphenyl-oxazole
TL;DR: 2-Bromomethyl-4,5-diphenyl-oxazole (CAS 81819-14-9) is a chemical compound with molecular formula C16H12BrNO and molecular weight 313.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(bromomethyl)-4,5-diphenyl-1,3-oxazole
Also Known As: 2-Bromomethyl-4,5-diphenyl-oxazole, 2-(Bromomethyl)-4,5-diphenyloxazole, 2-bromomethyl-4,5-diphenyloxazole, 4,5-diphenyl-2-bromomethyloxazole, 2 -Bromomethyl-4,5-diphenyl-oxazole
| Molecular Formula | C16H12BrNO |
|---|---|
| Molecular Weight | 313.01 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.01022 |
| Heavy Atoms | 19 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 81819-14-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(OC(=N2)CBr)C3=CC=CC=C3 |
| InChIKey | MVWFPJCRUALBMA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromomethyl-4,5-diphenyl-oxazole (CAS 81819-14-9), with molecular formula C16H12BrNO and molecular weight 313.01 g/mol. IUPAC: 2-(bromomethyl)-4,5-diphenyl-1,3-oxazole.
Chemical Property Profile of 2-Bromomethyl-4,5-diphenyl-oxazole
Property Insights of 2-Bromomethyl-4,5-diphenyl-oxazole
The XLogP value of 5.0 indicates that 2-Bromomethyl-4,5-diphenyl-oxazole 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-Bromomethyl-4,5-diphenyl-oxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromomethyl-4,5-diphenyl-oxazole 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-Bromomethyl-4,5-diphenyl-oxazole?
The CAS number of 2-Bromomethyl-4,5-diphenyl-oxazole is 81819-14-9.
What is the molecular formula of 2-Bromomethyl-4,5-diphenyl-oxazole?
The molecular formula of 2-Bromomethyl-4,5-diphenyl-oxazole is C16H12BrNO.
What is the molecular weight of 2-Bromomethyl-4,5-diphenyl-oxazole?
The molecular weight of 2-Bromomethyl-4,5-diphenyl-oxazole is 313.01 g/mol.
Where can I buy 2-Bromomethyl-4,5-diphenyl-oxazole?
You can request a quote for 2-Bromomethyl-4,5-diphenyl-oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromomethyl-4,5-diphenyl-oxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromomethyl-4,5-diphenyl-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.