2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole
TL;DR: 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole (CAS 338405-22-4) is a chemical compound with molecular formula C11H9N5O and molecular weight 227.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-5-(1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole
Also Known As: 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole, 2-phenyl-5-(1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole, 3F-032, 2-phenyl-5-[(1H-1,2,4-triazol-1-yl)methyl]-1,3,4-oxadiazole
| Molecular Formula | C11H9N5O |
|---|---|
| Molecular Weight | 227.08 g/mol |
| LogP | 1.3764 |
| Topological Polar Surface Area | 69.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.0807 |
| Heavy Atoms | 17 |
| Complexity | 587.3764 |
Chemical Identifiers
| CAS Number | 338405-22-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=C(O2)CN3C=NC=N3 |
Product Overview
2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole (CAS 338405-22-4), with molecular formula C11H9N5O and molecular weight 227.08 g/mol. IUPAC: 2-phenyl-5-(1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole.
Chemical Property Profile of 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole
Property Insights of 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole
The XLogP value of 1.3764 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole. The TPSA of 69.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole. Following Lipinski's Rule of Five, 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole has 0 hydrogen bond donor(s) and 5 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-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole?
The CAS number of 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole is 338405-22-4.
What is the molecular formula of 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole?
The molecular formula of 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole is C11H9N5O.
What is the molecular weight of 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole?
The molecular weight of 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole is 227.08 g/mol.
Where can I buy 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole?
You can request a quote for 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-phenyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.