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Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate
TL;DR: Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate (CAS 332943-13-2) is a chemical compound with molecular formula C14H15NO7 and molecular weight 309.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[(2-ethoxy-2-oxoacetyl)amino]benzene-1,4-dicarboxylate
Also Known As: BAS 01935690, 2-(Ethoxyoxalyl-amino)-terephthalic acid dimethyl ester, dimethyl 2-(2-ethoxy-2-oxoacetamido)terephthalate, dimethyl 2-{[ethoxy(oxo)acetyl]amino}benzene-1,4-dicarboxylate, dimethyl 2-[(2-ethoxy-2-oxoacetyl)amino]benzene-1,4-dicarboxylate
| Molecular Formula | C14H15NO7 |
|---|---|
| Molecular Weight | 309.08 g/mol |
| LogP | 0.7614 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.08484 |
| Heavy Atoms | 22 |
| Complexity | 609.209 |
Chemical Identifiers
| CAS Number | 332943-13-2 |
|---|---|
| SMILES | CCOC(=O)C(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC |
Product Overview
Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate (CAS 332943-13-2), with molecular formula C14H15NO7 and molecular weight 309.08 g/mol. IUPAC: dimethyl 2-[(2-ethoxy-2-oxoacetyl)amino]benzene-1,4-dicarboxylate.
Chemical Property Profile of Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate
Property Insights of Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate
The XLogP value of 0.7614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate. Following Lipinski's Rule of Five, Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate has 1 hydrogen bond donor(s) and 7 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 Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate?
The CAS number of Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate is 332943-13-2.
What is the molecular formula of Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate?
The molecular formula of Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate is C14H15NO7.
What is the molecular weight of Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate?
The molecular weight of Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate is 309.08 g/mol.
Where can I buy Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate?
You can request a quote for Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(ethoxycarbonyl)carbonylamino]-4-(methoxycarbonyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.