methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate
TL;DR: methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate (CAS 488086-52-8) is a chemical compound with molecular formula C20H20F6N2O3S and molecular weight 482.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-ethyl-2-[[1,1,1,3,3,3-hexafluoro-2-[(2-phenylacetyl)amino]propan-2-yl]amino]-5-methylthiophene-3-carboxylate
Also Known As: methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate, methyl 4-ethyl-2-({1,1,1,3,3,3-hexafluoro-2-[(phenylacetyl)amino]propan-2-yl}amino)-5-methylthiophene-3-carboxylate, methyl 4-ethyl-2-[[1,1,1,3,3,3-hexafluoro-2-[(2-phenylacetyl)amino]propan-2-yl]amino]-5-methylthiophene-3-carboxylate, METHYL 4-ETHYL-2-{[1,1,1,3,3,3-HEXAFLUORO-2-(2-PHENYLACETAMIDO)PROPAN-2-YL]AMINO}-5-METHYLTHIOPHENE-3-CARBOXYLATE
| Molecular Formula | C20H20F6N2O3S |
|---|---|
| Molecular Weight | 482.11 g/mol |
| LogP | 4.99722 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 482.1099 |
| Heavy Atoms | 32 |
| Complexity | 956.1952 |
Chemical Identifiers
| CAS Number | 488086-52-8 |
|---|---|
| SMILES | CCC1=C(SC(=C1C(=O)OC)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CC2=CC=CC=C2)C |
Product Overview
methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate (CAS 488086-52-8), with molecular formula C20H20F6N2O3S and molecular weight 482.11 g/mol. IUPAC: methyl 4-ethyl-2-[[1,1,1,3,3,3-hexafluoro-2-[(2-phenylacetyl)amino]propan-2-yl]amino]-5-methylthiophene-3-carboxylate.
Chemical Property Profile of methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate
Property Insights of methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate
The XLogP value of 4.99722 indicates that methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate 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 methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate?
The CAS number of methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate is 488086-52-8.
What is the molecular formula of methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate?
The molecular formula of methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate is C20H20F6N2O3S.
What is the molecular weight of methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate?
The molecular weight of methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate is 482.11 g/mol.
Where can I buy methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate?
You can request a quote for methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-ethyl-2-((1,1,1,3,3,3-hexafluoro-2-(2-phenylacetamido)propan-2-yl)amino)-5-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.