Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)-
TL;DR: Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)- (CAS 154131-65-4) is a chemical compound with molecular formula C14H12N2O and molecular weight 224.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole
Also Known As: 3-(3-Pyridyl)-5-phenylisoxazoline, 3-(3-Pyridyl)-5-phenyl-2-isoxazoline, 3-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)pyridine, Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)-, J1.261.306G
| Molecular Formula | C14H12N2O |
|---|---|
| Molecular Weight | 224.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.09496 |
| Heavy Atoms | 17 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 154131-65-4 |
|---|---|
| SMILES | C1C(ON=C1C2=CN=CC=C2)C3=CC=CC=C3 |
| InChIKey | SYCIBYJUPBHOCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)- (CAS 154131-65-4), with molecular formula C14H12N2O and molecular weight 224.09 g/mol. IUPAC: 5-phenyl-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole.
Chemical Property Profile of Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)-
Property Insights of Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)-. With a topological polar surface area (TPSA) of 34.5 Ų, Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)- 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 Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)-?
The CAS number of Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)- is 154131-65-4.
What is the molecular formula of Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)-?
The molecular formula of Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)- is C14H12N2O.
What is the molecular weight of Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)-?
The molecular weight of Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)- is 224.09 g/mol.
Where can I buy Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)-?
You can request a quote for Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyridine, 3-(4,5-dihydro-5-phenyl-3-isoxazolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.