(E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine
TL;DR: (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine (CAS 110684-49-6) is a chemical compound with molecular formula C12H9BrN2 and molecular weight 259.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-1-pyridin-3-ylmethanimine
Also Known As: N-(4-Bromophenyl)-3-pyridylmethyleneamine, (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine, J1.829.813I, N-(4-bromophenyl)-1-pyridin-3-ylmethanimine, N-(4-bromophenyl)-1-(pyridin-3-yl)methanimine
| Molecular Formula | C12H9BrN2 |
|---|---|
| Molecular Weight | 259.99 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.9949 |
| Heavy Atoms | 15 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 110684-49-6 |
|---|---|
| SMILES | C1=CC(=CN=C1)C=NC2=CC=C(C=C2)Br |
| InChIKey | LQALUXRSHXJOAK-UHFFFAOYSA-N |
Product Overview
(E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine (CAS 110684-49-6), with molecular formula C12H9BrN2 and molecular weight 259.99 g/mol. IUPAC: N-(4-bromophenyl)-1-pyridin-3-ylmethanimine.
Chemical Property Profile of (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine
Property Insights of (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine. With a topological polar surface area (TPSA) of 25.3 Ų, (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine has 0 hydrogen bond donor(s) and 2 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 (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine?
The CAS number of (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine is 110684-49-6.
What is the molecular formula of (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine?
The molecular formula of (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine is C12H9BrN2.
What is the molecular weight of (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine?
The molecular weight of (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine is 259.99 g/mol.
Where can I buy (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine?
You can request a quote for (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-bromo-N-(pyridin-3-ylmethylene)benzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.