(E)-3-(4-bromostyryl)quinoxalin-2(1H)-one
TL;DR: (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one (CAS 1022161-36-9) is a chemical compound with molecular formula C16H11BrN2O and molecular weight 326.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(E)-2-(4-bromophenyl)ethenyl]-1H-quinoxalin-2-one
Also Known As: (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one, 3-[(E)-2-(4-bromophenyl)ethenyl]-1H-quinoxalin-2-one, AB00675814-01, F1792-0001, 3-[(E)-2-(p-bromophenyl)ethenyl]-2(1H)-quinoxalinone
| Molecular Formula | C16H11BrN2O |
|---|---|
| Molecular Weight | 326.01 g/mol |
| LogP | 3.856 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.0055 |
| Heavy Atoms | 20 |
| Complexity | 834.96985 |
Chemical Identifiers
| CAS Number | 1022161-36-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=O)C(=N2)/C=C/C3=CC=C(C=C3)Br |
Product Overview
(E)-3-(4-bromostyryl)quinoxalin-2(1H)-one (CAS 1022161-36-9), with molecular formula C16H11BrN2O and molecular weight 326.01 g/mol. IUPAC: 3-[(E)-2-(4-bromophenyl)ethenyl]-1H-quinoxalin-2-one.
Chemical Property Profile of (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one
Property Insights of (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one
The XLogP value of 3.856 indicates that (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.75 Ų, (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one has 1 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)-3-(4-bromostyryl)quinoxalin-2(1H)-one?
The CAS number of (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one is 1022161-36-9.
What is the molecular formula of (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one?
The molecular formula of (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one is C16H11BrN2O.
What is the molecular weight of (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one?
The molecular weight of (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one is 326.01 g/mol.
Where can I buy (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one?
You can request a quote for (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(4-bromostyryl)quinoxalin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.