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Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate
TL;DR: Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate (CAS 420091-70-9) is a chemical compound with molecular formula C18H19NO7S and molecular weight 393.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: BAS 06653617, dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate, dimethyl 5-(3,4-dimethoxybenzamido)-3-methylthiophene-2,4-dicarboxylate, dimethyl 5-{[(3,4-dimethoxyphenyl)carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate, methyl 2-[(3,4-dimethoxyphenyl)carbonylamino]-5-(methoxycarbonyl)-4-methylthio phene-3-carboxylate
| Molecular Formula | C18H19NO7S |
|---|---|
| Molecular Weight | 393.09 g/mol |
| LogP | 2.89922 |
| Topological Polar Surface Area | 100.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 393.08823 |
| Heavy Atoms | 27 |
| Complexity | 888.07556 |
Chemical Identifiers
| CAS Number | 420091-70-9 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=C(C=C2)OC)OC)C(=O)OC |
Product Overview
Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate (CAS 420091-70-9), with molecular formula C18H19NO7S and molecular weight 393.09 g/mol. IUPAC: dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate
Property Insights of Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate
The XLogP value of 2.89922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate. The TPSA of 100.16 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate 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 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate?
The CAS number of Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate is 420091-70-9.
What is the molecular formula of Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate?
The molecular formula of Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate is C18H19NO7S.
What is the molecular weight of Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate?
The molecular weight of Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate is 393.09 g/mol.
Where can I buy Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate?
You can request a quote for Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.