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Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate
TL;DR: Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate (CAS 329059-27-0) is a chemical compound with molecular formula C17H14ClNO5 and molecular weight 347.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate
Also Known As: dimethyl 2-[(2-chlorobenzoyl)amino]terephthalate, dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate, AO-548/11634097, DIMETHYL 2-((2-CHLOROBENZOYL)AMINO)TEREPHTHALATE, 1,4-DIMETHYL 2-(2-CHLOROBENZAMIDO)BENZENE-1,4-DICARBOXYLATE
| Molecular Formula | C17H14ClNO5 |
|---|---|
| Molecular Weight | 347.06 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 347.05606 |
| Heavy Atoms | 24 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 329059-27-0 |
|---|---|
| SMILES | COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC=CC=C2Cl |
| InChIKey | ZDFDDBPLKKQDPO-UHFFFAOYSA-N |
Product Overview
Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate (CAS 329059-27-0), with molecular formula C17H14ClNO5 and molecular weight 347.06 g/mol. IUPAC: dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate.
Chemical Property Profile of Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate
Property Insights of Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate
The XLogP value of 3.6 indicates that Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate has 1 hydrogen bond donor(s) and 5 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 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate?
The CAS number of Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate is 329059-27-0.
What is the molecular formula of Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate?
The molecular formula of Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate is C17H14ClNO5.
What is the molecular weight of Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate?
The molecular weight of Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate is 347.06 g/mol.
Where can I buy Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate?
You can request a quote for Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-[(2-chlorobenzoyl)amino]benzene-1,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.