(E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate
TL;DR: (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate (CAS 403830-22-8) is a chemical compound with molecular formula C19H13BrN2O2 and molecular weight 380.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(3-bromophenyl)iminomethyl]phenyl] pyridine-4-carboxylate
Also Known As: IFLab1_004286, IDI1_010041, (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate, [4-[(3-bromophenyl)iminomethyl]phenyl] pyridine-4-carboxylate, 4-[(1E)-[(3-bromophenyl)imino]methyl]phenyl pyridine-4-carboxylate
| Molecular Formula | C19H13BrN2O2 |
|---|---|
| Molecular Weight | 380.02 g/mol |
| LogP | 4.8139 |
| Topological Polar Surface Area | 51.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.01605 |
| Heavy Atoms | 24 |
| Complexity | 862.05 |
Chemical Identifiers
| CAS Number | 403830-22-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)N=CC2=CC=C(C=C2)OC(=O)C3=CC=NC=C3 |
Product Overview
(E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate (CAS 403830-22-8), with molecular formula C19H13BrN2O2 and molecular weight 380.02 g/mol. IUPAC: [4-[(3-bromophenyl)iminomethyl]phenyl] pyridine-4-carboxylate.
Chemical Property Profile of (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate
Property Insights of (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate
The XLogP value of 4.8139 indicates that (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.55 Ų, (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate 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 (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate?
The CAS number of (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate is 403830-22-8.
What is the molecular formula of (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate?
The molecular formula of (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate is C19H13BrN2O2.
What is the molecular weight of (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate?
The molecular weight of (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate is 380.02 g/mol.
Where can I buy (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate?
You can request a quote for (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-(((3-bromophenyl)imino)methyl)phenyl isonicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.