Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate
TL;DR: Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate (CAS 420094-89-9) is a chemical compound with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate
Also Known As: ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate, ethyl 4-carbamoyl-3-methyl-5-[(2-phenoxybutanoyl)amino]thiophene-2-carboxylate, ethyl 4-(aminocarbonyl)-3-methyl-5-[(2-phenoxybutanoyl)amino]thiophene-2-carboxylate, ETHYL 4-(AMINOCARBONYL)-3-METHYL-5-[(2-PHENOXYBUTANOYL)AMINO]-2-THIOPHENECARBOXYLATE
| Molecular Formula | C19H22N2O5S |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 3.12822 |
| Topological Polar Surface Area | 107.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 390.12494 |
| Heavy Atoms | 27 |
| Complexity | 832.1256 |
Chemical Identifiers
| CAS Number | 420094-89-9 |
|---|---|
| SMILES | CCC(C(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)N)OC2=CC=CC=C2 |
Product Overview
Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate (CAS 420094-89-9), with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol. IUPAC: ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate.
Chemical Property Profile of Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate
Property Insights of Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate
The XLogP value of 3.12822 indicates that Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.72 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate has 2 hydrogen bond donor(s) and 6 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 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate?
The CAS number of Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate is 420094-89-9.
What is the molecular formula of Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate?
The molecular formula of Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate is C19H22N2O5S.
What is the molecular weight of Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate?
The molecular weight of Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate is 390.12 g/mol.
Where can I buy Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate?
You can request a quote for Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-carbamoyl-3-methyl-5-(2-phenoxybutanoylamino)thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.