![Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate structure](/static/products/7089/708992-29-4.webp)
Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate
TL;DR: Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate (CAS 708992-29-4) is a chemical compound with molecular formula C19H18BrNO6 and molecular weight 435.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]benzene-1,3-dicarboxylate
Also Known As: AP-970/42783348, dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate, dimethyl 5-(5-bromo-2-methoxy-3-methylbenzamido)isophthalate, dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]benzene-1,3-dicarboxylate, dimethyl 5-{[(5-bromo-2-methoxy-3-methylphenyl)carbonyl]amino}benzene-1,3-dicarboxylate
| Molecular Formula | C19H18BrNO6 |
|---|---|
| Molecular Weight | 435.03 g/mol |
| LogP | 3.59162 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 435.03174 |
| Heavy Atoms | 27 |
| Complexity | 875.0632 |
Chemical Identifiers
| CAS Number | 708992-29-4 |
|---|---|
| SMILES | CC1=CC(=CC(=C1OC)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)Br |
Product Overview
Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate (CAS 708992-29-4), with molecular formula C19H18BrNO6 and molecular weight 435.03 g/mol. IUPAC: dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]benzene-1,3-dicarboxylate.
Chemical Property Profile of Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate
Property Insights of Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate
The XLogP value of 3.59162 indicates that Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate 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-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate. Following Lipinski's Rule of Five, Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate 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-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate?
The CAS number of Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate is 708992-29-4.
What is the molecular formula of Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate?
The molecular formula of Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate is C19H18BrNO6.
What is the molecular weight of Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate?
The molecular weight of Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate is 435.03 g/mol.
Where can I buy Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate?
You can request a quote for Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]isophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.