1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime
TL;DR: 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime (CAS 329048-08-0) is a chemical compound with molecular formula C14H11BrN2O2 and molecular weight 318.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-1-pyridin-2-ylethylideneamino] 4-bromobenzoate
Also Known As: 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime, [(E)-1-pyridin-2-ylethylideneamino] 4-bromobenzoate, (E)-1-(pyridin-2-yl)ethanone O-(4-bromobenzoyl) oxime, (4-bromophenyl)({[(1E)-1-(pyridin-2-yl)ethylidene]amino}oxy)methanone
| Molecular Formula | C14H11BrN2O2 |
|---|---|
| Molecular Weight | 318.00 g/mol |
| LogP | 3.4251 |
| Topological Polar Surface Area | 51.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.0004 |
| Heavy Atoms | 19 |
| Complexity | 594.60284 |
Chemical Identifiers
| CAS Number | 329048-08-0 |
|---|---|
| SMILES | C/C(=N\OC(=O)C1=CC=C(C=C1)Br)/C2=CC=CC=N2 |
Product Overview
1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime (CAS 329048-08-0), with molecular formula C14H11BrN2O2 and molecular weight 318.00 g/mol. IUPAC: [(E)-1-pyridin-2-ylethylideneamino] 4-bromobenzoate.
Chemical Property Profile of 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime
Property Insights of 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime
The XLogP value of 3.4251 indicates that 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.55 Ų, 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime has 0 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 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime?
The CAS number of 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime is 329048-08-0.
What is the molecular formula of 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime?
The molecular formula of 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime is C14H11BrN2O2.
What is the molecular weight of 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime?
The molecular weight of 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime is 318.00 g/mol.
Where can I buy 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime?
You can request a quote for 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-pyridinyl)ethanone O-(4-bromobenzoyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.