![Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate structure](/static/products/6233/6233-39-2.webp)
Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate
TL;DR: Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate (CAS 6233-39-2) is a chemical compound with molecular formula C18H16BrNO6 and molecular weight 421.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate
Also Known As: CBKinase1_001206, CBKinase1_013606, BAS 02245031, dimethyl 5-{[(4-bromophenoxy)acetyl]amino}isophthalate, BIM-0014239.P001
| Molecular Formula | C18H16BrNO6 |
|---|---|
| Molecular Weight | 421.02 g/mol |
| LogP | 3.0398 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.0161 |
| Heavy Atoms | 26 |
| Complexity | 784.6811 |
Chemical Identifiers
| CAS Number | 6233-39-2 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=C1)NC(=O)COC2=CC=C(C=C2)Br)C(=O)OC |
Product Overview
Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate (CAS 6233-39-2), with molecular formula C18H16BrNO6 and molecular weight 421.02 g/mol. IUPAC: dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate.
Chemical Property Profile of Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate
Property Insights of Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate
The XLogP value of 3.0398 indicates that Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate has 1 hydrogen bond donor(s) and 6 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 Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate?
The CAS number of Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate is 6233-39-2.
What is the molecular formula of Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate?
The molecular formula of Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate is C18H16BrNO6.
What is the molecular weight of Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate?
The molecular weight of Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate is 421.02 g/mol.
Where can I buy Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate?
You can request a quote for Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 5-[[2-(4-bromophenoxy)acetyl]amino]benzene-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.