ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate
TL;DR: ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate (CAS 438212-37-4) is a chemical compound with molecular formula C17H16Cl2N2O4S and molecular weight 414.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-carbamoyl-2-[[2-(2,6-dichlorophenyl)acetyl]amino]-4-methylthiophene-3-carboxylate
Also Known As: ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate, ethyl 5-carbamoyl-2-[[2-(2,6-dichlorophenyl)acetyl]amino]-4-methylthiophene-3-carboxylate, ethyl 5-carbamoyl-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methylthiophene-3-carboxylate, ethyl 2-[2-(2,6-dichlorophenyl)acetylamino]-5-carbamoyl-4-methylthiophene-3-ca rboxylate
| Molecular Formula | C17H16Cl2N2O4S |
|---|---|
| Molecular Weight | 414.02 g/mol |
| LogP | 3.82012 |
| Topological Polar Surface Area | 98.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.02078 |
| Heavy Atoms | 26 |
| Complexity | 859.6381 |
Chemical Identifiers
| CAS Number | 438212-37-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CC2=C(C=CC=C2Cl)Cl |
Product Overview
ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate (CAS 438212-37-4), with molecular formula C17H16Cl2N2O4S and molecular weight 414.02 g/mol. IUPAC: ethyl 5-carbamoyl-2-[[2-(2,6-dichlorophenyl)acetyl]amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate
Property Insights of ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate
The XLogP value of 3.82012 indicates that ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.49 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate. Following Lipinski's Rule of Five, ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate has 2 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 ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate?
The CAS number of ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate is 438212-37-4.
What is the molecular formula of ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate?
The molecular formula of ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate is C17H16Cl2N2O4S.
What is the molecular weight of ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate?
The molecular weight of ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate is 414.02 g/mol.
Where can I buy ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate?
You can request a quote for ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-(aminocarbonyl)-2-{[(2,6-dichlorophenyl)acetyl]amino}-4-methyl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.