3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole
TL;DR: 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole (CAS 453567-76-5) is a chemical compound with molecular formula C18H10N6O and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)-5-pyrimidin-5-ylbenzonitrile
Also Known As: 3-(pyridin-2-yl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole, 3-(2-pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole, 3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)-5-pyrimidin-5-yl-benzonitrile
| Molecular Formula | C18H10N6O |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 3.12728 |
| Topological Polar Surface Area | 101.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.0916 |
| Heavy Atoms | 25 |
| Complexity | 1053.8838 |
Chemical Identifiers
| CAS Number | 453567-76-5 |
|---|---|
| SMILES | C1=CC=NC(=C1)C2=NOC(=N2)C3=CC(=CC(=C3)C4=CN=CN=C4)C#N |
Product Overview
3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole (CAS 453567-76-5), with molecular formula C18H10N6O and molecular weight 326.09 g/mol. IUPAC: 3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)-5-pyrimidin-5-ylbenzonitrile.
Chemical Property Profile of 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole
Property Insights of 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole
The XLogP value of 3.12728 indicates that 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole. Following Lipinski's Rule of Five, 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 7 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-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole?
The CAS number of 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole is 453567-76-5.
What is the molecular formula of 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole?
The molecular formula of 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole is C18H10N6O.
What is the molecular weight of 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole?
The molecular weight of 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole is 326.09 g/mol.
Where can I buy 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole?
You can request a quote for 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Pyridyl)-5-(3-cyano-5-(5-pyrimidyl)phenyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.