![Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate structure](/static/products/489/489462-07-9.png)
Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate
TL;DR: Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate (CAS 489462-07-9) is a chemical compound with molecular formula C23H18BrN3O3 and molecular weight 463.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[4-(3-bromoanilino)phthalazin-1-yl]phenoxy]acetate
Also Known As: methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate, methyl 2-[4-[4-(3-bromoanilino)phthalazin-1-yl]phenoxy]acetate, methyl 2-(4-(4-((3-bromophenyl)amino)phthalazin-1-yl)phenoxy)acetate, Methyl 2-[4-[4-[(3-bromophenyl)amino]phthalazin-1-yl]phenoxy]acetate
| Molecular Formula | C23H18BrN3O3 |
|---|---|
| Molecular Weight | 463.05 g/mol |
| LogP | 5.3547 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.05316 |
| Heavy Atoms | 30 |
| Complexity | 1195.9158 |
Chemical Identifiers
| CAS Number | 489462-07-9 |
|---|---|
| SMILES | COC(=O)COC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=CC=C4)Br |
Product Overview
Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate (CAS 489462-07-9), with molecular formula C23H18BrN3O3 and molecular weight 463.05 g/mol. IUPAC: methyl 2-[4-[4-(3-bromoanilino)phthalazin-1-yl]phenoxy]acetate.
Chemical Property Profile of Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate
Property Insights of Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate
The XLogP value of 5.3547 indicates that Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate. Following Lipinski's Rule of Five, Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate?
The CAS number of Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate is 489462-07-9.
What is the molecular formula of Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate?
The molecular formula of Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate is C23H18BrN3O3.
What is the molecular weight of Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate?
The molecular weight of Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate is 463.05 g/mol.
Where can I buy Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate?
You can request a quote for Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.