4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline
TL;DR: 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline (CAS 915916-80-2) is a chemical compound with molecular formula C12H14BrN3O and molecular weight 295.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline
Also Known As: 4-bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline, AT-057/43469549, 4-bromo-2-(5-butyl(1,3,4-oxadiazol-2-yl))phenylamine
| Molecular Formula | C12H14BrN3O |
|---|---|
| Molecular Weight | 295.03 g/mol |
| LogP | 3.4239 |
| Topological Polar Surface Area | 64.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.032 |
| Heavy Atoms | 17 |
| Complexity | 510.2019 |
Chemical Identifiers
| CAS Number | 915916-80-2 |
|---|---|
| SMILES | CCCCC1=NN=C(O1)C2=C(C=CC(=C2)Br)N |
Product Overview
4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline (CAS 915916-80-2), with molecular formula C12H14BrN3O and molecular weight 295.03 g/mol. IUPAC: 4-bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline.
Chemical Property Profile of 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline
Property Insights of 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline
The XLogP value of 3.4239 indicates that 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline. Following Lipinski's Rule of Five, 4-Bromo-2-(5-butyl-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
Frequently Asked Questions
What is the CAS number of 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline?
The CAS number of 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline is 915916-80-2.
What is the molecular formula of 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline?
The molecular formula of 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline is C12H14BrN3O.
What is the molecular weight of 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline?
The molecular weight of 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline is 295.03 g/mol.
Where can I buy 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline?
You can request a quote for 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-(5-butyl-1,3,4-oxadiazol-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.