N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide
TL;DR: N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide (CAS 897735-77-2) is a chemical compound with molecular formula C12H12BrN3O2 and molecular weight 309.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]-2-methylpropanamide
Also Known As: AB00679160-01, F2518-0520, N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide, N-[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]-2-methylpropanamide, N-[5-(p-bromophenyl)-1,3,4-oxadiazol-2-yl]2-methylpropionamide
| Molecular Formula | C12H12BrN3O2 |
|---|---|
| Molecular Weight | 309.01 g/mol |
| LogP | 3.0936 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.0113 |
| Heavy Atoms | 18 |
| Complexity | 548.7051 |
Chemical Identifiers
| CAS Number | 897735-77-2 |
|---|---|
| SMILES | CC(C)C(=O)NC1=NN=C(O1)C2=CC=C(C=C2)Br |
Product Overview
N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide (CAS 897735-77-2), with molecular formula C12H12BrN3O2 and molecular weight 309.01 g/mol. IUPAC: N-[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]-2-methylpropanamide.
Chemical Property Profile of N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide
Property Insights of N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide
The XLogP value of 3.0936 indicates that N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide. Following Lipinski's Rule of Five, N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide 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 N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide?
The CAS number of N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide is 897735-77-2.
What is the molecular formula of N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide?
The molecular formula of N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide is C12H12BrN3O2.
What is the molecular weight of N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide?
The molecular weight of N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide is 309.01 g/mol.
Where can I buy N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide?
You can request a quote for N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)isobutyramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.