(Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide
TL;DR: (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide (CAS 691376-82-6) is a chemical compound with molecular formula C13H9Br2NO2 and molecular weight 368.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dibromo-4-[(N-hydroxyanilino)methylidene]cyclohexa-2,5-dien-1-one
Also Known As: IFLab1_006028, (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide, 2,6-dibromo-4-[(hydroxyphenylylidene)methyl]phenol, (NZ)-N-[(3,5-DIBROMO-4-HYDROXYPHENYL)METHYLIDENE]-N-OXIDOANILINIUM, F1593-0012
| Molecular Formula | C13H9Br2NO2 |
|---|---|
| Molecular Weight | 368.90 g/mol |
| LogP | 3.9064 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 368.9 |
| Heavy Atoms | 18 |
| Complexity | 537.6138 |
Chemical Identifiers
| CAS Number | 691376-82-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(C=C2C=C(C(=O)C(=C2)Br)Br)O |
Product Overview
(Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide (CAS 691376-82-6), with molecular formula C13H9Br2NO2 and molecular weight 368.90 g/mol. IUPAC: 2,6-dibromo-4-[(N-hydroxyanilino)methylidene]cyclohexa-2,5-dien-1-one.
Chemical Property Profile of (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide
Property Insights of (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide
The XLogP value of 3.9064 indicates that (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.54 Ų, (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide has 1 hydrogen bond donor(s) and 3 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 (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide?
The CAS number of (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide is 691376-82-6.
What is the molecular formula of (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide?
The molecular formula of (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide is C13H9Br2NO2.
What is the molecular weight of (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide?
The molecular weight of (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide is 368.90 g/mol.
Where can I buy (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide?
You can request a quote for (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(3,5-dibromo-4-hydroxybenzylidene)aniline oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.