![Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate structure](/static/products/5460/546064-75-9.webp)
Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate
TL;DR: Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate (CAS 546064-75-9) is a chemical compound with molecular formula C26H20FNO3S and molecular weight 445.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylate
Also Known As: Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate, Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylate, Methyl 2-(2,2-diphenylacetamido)-4-(4-fluorophenyl)thiophene-3-carboxylate
| Molecular Formula | C26H20FNO3S |
|---|---|
| Molecular Weight | 445.11 g/mol |
| LogP | 6.1114 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.1148 |
| Heavy Atoms | 32 |
| Complexity | 1181.6888 |
Chemical Identifiers
| CAS Number | 546064-75-9 |
|---|---|
| SMILES | COC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate (CAS 546064-75-9), with molecular formula C26H20FNO3S and molecular weight 445.11 g/mol. IUPAC: methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylate.
Chemical Property Profile of Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate
Property Insights of Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate
The XLogP value of 6.1114 indicates that Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate?
The CAS number of Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate is 546064-75-9.
What is the molecular formula of Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate?
The molecular formula of Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate is C26H20FNO3S.
What is the molecular weight of Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate?
The molecular weight of Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate is 445.11 g/mol.
Where can I buy Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate?
You can request a quote for Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(2,2-diphenylacetyl)amino]-4-(4-fluorophenyl)-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.