![2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate structure](/static/products/4381/438199-40-7.webp)
2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate
TL;DR: 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate (CAS 438199-40-7) is a chemical compound with molecular formula C21H25NO6S and molecular weight 419.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-methyl 4-O-propyl 5-[[2-(3,4-dimethylphenoxy)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate, 2-O-methyl 4-O-propyl 5-[[2-(3,4-dimethylphenoxy)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate, 2-methyl 4-propyl 5-(2-(3,4-dimethylphenoxy)acetamido)-3-methylthiophene-2,4-dicarboxylate, 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methylthiophene-2,4-dicarboxylate, propyl 2-[2-(3,4-dimethylphenoxy)acetylamino]-5-(methoxycarbonyl)-4-methylthio phene-3-carboxylate
| Molecular Formula | C21H25NO6S |
|---|---|
| Molecular Weight | 419.14 g/mol |
| LogP | 4.04426 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 419.14026 |
| Heavy Atoms | 29 |
| Complexity | 918.13544 |
Chemical Identifiers
| CAS Number | 438199-40-7 |
|---|---|
| SMILES | CCCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)COC2=CC(=C(C=C2)C)C |
Product Overview
2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate (CAS 438199-40-7), with molecular formula C21H25NO6S and molecular weight 419.14 g/mol. IUPAC: 2-O-methyl 4-O-propyl 5-[[2-(3,4-dimethylphenoxy)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate
Property Insights of 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate
The XLogP value of 4.04426 indicates that 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate 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 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate. Following Lipinski's Rule of Five, 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate 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 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate?
The CAS number of 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate is 438199-40-7.
What is the molecular formula of 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate?
The molecular formula of 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate is C21H25NO6S.
What is the molecular weight of 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate?
The molecular weight of 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate is 419.14 g/mol.
Where can I buy 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate?
You can request a quote for 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl 4-propyl 5-{[(3,4-dimethylphenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.