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Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate
TL;DR: Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate (CAS 346725-69-7) is a chemical compound with molecular formula C23H27NO8 and molecular weight 445.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]benzene-1,4-dicarboxylate
Also Known As: BIM-0028322.P001, dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate, dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]benzene-1,4-dicarboxylate, 1,4-dimethyl 2-[(3,4,5-triethoxybenzene)amido]benzene-1,4-dicarboxylate, methyl 4-(methoxycarbonyl)-3-[(3,4,5-triethoxyphenyl)carbonylamino]benzoate
| Molecular Formula | C23H27NO8 |
|---|---|
| Molecular Weight | 445.17 g/mol |
| LogP | 3.7082 |
| Topological Polar Surface Area | 109.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 445.17368 |
| Heavy Atoms | 32 |
| Complexity | 958.95197 |
Chemical Identifiers
| CAS Number | 346725-69-7 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC |
Product Overview
Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate (CAS 346725-69-7), with molecular formula C23H27NO8 and molecular weight 445.17 g/mol. IUPAC: dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]benzene-1,4-dicarboxylate.
Chemical Property Profile of Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate
Property Insights of Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate
The XLogP value of 3.7082 indicates that Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate. Following Lipinski's Rule of Five, Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate has 1 hydrogen bond donor(s) and 8 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-[(3,4,5-triethoxybenzoyl)amino]terephthalate?
The CAS number of Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate is 346725-69-7.
What is the molecular formula of Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate?
The molecular formula of Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate is C23H27NO8.
What is the molecular weight of Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate?
The molecular weight of Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate is 445.17 g/mol.
Where can I buy Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate?
You can request a quote for Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-[(3,4,5-triethoxybenzoyl)amino]terephthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.