3-Benzyl-5-tert-butyl-1,2-oxazole
TL;DR: 3-Benzyl-5-tert-butyl-1,2-oxazole (CAS 374093-72-8) is a chemical compound with molecular formula C14H17NO and molecular weight 215.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-5-tert-butyl-1,2-oxazole
Also Known As: 3-benzyl-5-tert-butyl-1,2-oxazole, 3-benzyl-5-(tert-butyl)isoxazole, BIM-0022776.P001
| Molecular Formula | C14H17NO |
|---|---|
| Molecular Weight | 215.13 g/mol |
| LogP | 3.5629 |
| Topological Polar Surface Area | 26.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.13101 |
| Heavy Atoms | 16 |
| Complexity | 451.08762 |
Chemical Identifiers
| CAS Number | 374093-72-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=NO1)CC2=CC=CC=C2 |
Product Overview
3-Benzyl-5-tert-butyl-1,2-oxazole (CAS 374093-72-8), with molecular formula C14H17NO and molecular weight 215.13 g/mol. IUPAC: 3-benzyl-5-tert-butyl-1,2-oxazole.
Chemical Property Profile of 3-Benzyl-5-tert-butyl-1,2-oxazole
Property Insights of 3-Benzyl-5-tert-butyl-1,2-oxazole
The XLogP value of 3.5629 indicates that 3-Benzyl-5-tert-butyl-1,2-oxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.03 Ų, 3-Benzyl-5-tert-butyl-1,2-oxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzyl-5-tert-butyl-1,2-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 3-Benzyl-5-tert-butyl-1,2-oxazole?
The CAS number of 3-Benzyl-5-tert-butyl-1,2-oxazole is 374093-72-8.
What is the molecular formula of 3-Benzyl-5-tert-butyl-1,2-oxazole?
The molecular formula of 3-Benzyl-5-tert-butyl-1,2-oxazole is C14H17NO.
What is the molecular weight of 3-Benzyl-5-tert-butyl-1,2-oxazole?
The molecular weight of 3-Benzyl-5-tert-butyl-1,2-oxazole is 215.13 g/mol.
Where can I buy 3-Benzyl-5-tert-butyl-1,2-oxazole?
You can request a quote for 3-Benzyl-5-tert-butyl-1,2-oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzyl-5-tert-butyl-1,2-oxazole?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzyl-5-tert-butyl-1,2-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.