3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester
TL;DR: 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester (CAS 77261-18-8) is a chemical compound with molecular formula C21H19NO3S and molecular weight 365.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-phenyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate
Also Known As: 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester, Ethyl 4-phenyl-2-((phenylacetyl)amino)-3-thiophenecarboxylate, ethyl 4-phenyl-2-(2-phenylacetylamino)thiophene-3-carboxylate, ETHYL 4-PHENYL-2-(2-PHENYLACETAMIDO)THIOPHENE-3-CARBOXYLATE, ethyl 4-phenyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate
| Molecular Formula | C21H19NO3S |
|---|---|
| Molecular Weight | 365.11 g/mol |
| LogP | 4.773 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 365.10855 |
| Heavy Atoms | 26 |
| Complexity | 888.13434 |
Chemical Identifiers
| CAS Number | 77261-18-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CC3=CC=CC=C3 |
Product Overview
3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester (CAS 77261-18-8), with molecular formula C21H19NO3S and molecular weight 365.11 g/mol. IUPAC: ethyl 4-phenyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester
Property Insights of 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester
The XLogP value of 4.773 indicates that 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester has 1 hydrogen bond donor(s) and 4 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 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester?
The CAS number of 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester is 77261-18-8.
What is the molecular formula of 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester?
The molecular formula of 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester is C21H19NO3S.
What is the molecular weight of 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester?
The molecular weight of 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester is 365.11 g/mol.
Where can I buy 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester?
You can request a quote for 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Thiophenecarboxylic acid, 4-phenyl-2-((phenylacetyl)amino)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.