3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline
TL;DR: 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline (CAS 107559-05-7) is a chemical compound with molecular formula C14H11N3O and molecular weight 237.09021 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(5-phenyl-1,3,4-oxadiazol-2-yl)aniline
Also Known As: 3-(5-phenyl-1,3,4-oxadiazol-2-yl)aniline, US9034574, XXIII, BAS 00762979, BIM-0029951.P001, 3-(2-phenyl-1,3,4-oxadiazol-5-yl)aniline
Technical Specifications
| Molecular Formula | C14H11N3O |
| Molecular Weight | 237.09021 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 64.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.09021 Da |
| Heavy Atoms | 18 |
| Complexity | 268.0 |
| SMILES | C1=CC=C(C=C1)C2=NN=C(O2)C3=CC(=CC=C3)N |
| InChIKey | DOYLAQBXDHFRFB-UHFFFAOYSA-N |
Chemical Property Profile of 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline
Property Insights of 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline. Following Lipinski's Rule of Five, 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline?
The CAS number of 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline is 107559-05-7.
What is the molecular formula of 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline?
The molecular formula of 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline is C14H11N3O.
What is the molecular weight of 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline?
The molecular weight of 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline is 237.09021 g/mol.
Where can I buy 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline?
You can request a quote for 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline?
Yes, CoreyChem provides custom synthesis services for 3-(5-Phenyl-1,3,4-oxadiazol-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.