Oxazole, 4,5-diethyl
TL;DR: Oxazole, 4,5-diethyl (CAS 54026-91-4) is a chemical compound with molecular formula C7H11NO and molecular weight 125.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-diethyl-1,3-oxazole
Also Known As: Oxazole, 4,5-diethyl, Oxazole, 4,5-diethyl-, 4,5-diethyl-1,3-oxazole
| Molecular Formula | C7H11NO |
|---|---|
| Molecular Weight | 125.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 125.08406 |
| Heavy Atoms | 9 |
| Complexity | 85.0 |
Chemical Identifiers
| CAS Number | 54026-91-4 |
|---|---|
| SMILES | CCC1=C(OC=N1)CC |
| InChIKey | OCNQWGMIRHLWNN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Oxazole, 4,5-diethyl (CAS 54026-91-4), with molecular formula C7H11NO and molecular weight 125.08 g/mol. IUPAC: 4,5-diethyl-1,3-oxazole.
Chemical Property Profile of Oxazole, 4,5-diethyl
Property Insights of Oxazole, 4,5-diethyl
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxazole, 4,5-diethyl. With a topological polar surface area (TPSA) of 26.0 Ų, Oxazole, 4,5-diethyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxazole, 4,5-diethyl 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 Oxazole, 4,5-diethyl?
The CAS number of Oxazole, 4,5-diethyl is 54026-91-4.
What is the molecular formula of Oxazole, 4,5-diethyl?
The molecular formula of Oxazole, 4,5-diethyl is C7H11NO.
What is the molecular weight of Oxazole, 4,5-diethyl?
The molecular weight of Oxazole, 4,5-diethyl is 125.08 g/mol.
Where can I buy Oxazole, 4,5-diethyl?
You can request a quote for Oxazole, 4,5-diethyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxazole, 4,5-diethyl?
Yes, KEHONG BIO provides custom synthesis services for Oxazole, 4,5-diethyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.