isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate
TL;DR: isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate (CAS 445232-33-7) is a chemical compound with molecular formula C22H22FNO4S and molecular weight 415.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[(2,5-dimethylfuran-3-carbonyl)amino]-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate
Also Known As: isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate, isopropyl 2-[(2,5-dimethyl-3-furoyl)amino]-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylate, methylethyl 2-[(2,5-dimethyl(3-furyl))carbonylamino]-4-(4-fluorophenyl)-5-meth ylthiophene-3-carboxylate, propan-2-yl 2-[(2,5-dimethylfuran-3-carbonyl)amino]-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate, propan-2-yl 2-{[(2,5-dimethylfuran-3-yl)carbonyl]amino}-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate
| Molecular Formula | C22H22FNO4S |
|---|---|
| Molecular Weight | 415.13 g/mol |
| LogP | 5.88996 |
| Topological Polar Surface Area | 68.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 415.12537 |
| Heavy Atoms | 29 |
| Complexity | 1063.4204 |
Chemical Identifiers
| CAS Number | 445232-33-7 |
|---|---|
| SMILES | CC1=CC(=C(O1)C)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)F)C(=O)OC(C)C |
Product Overview
isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate (CAS 445232-33-7), with molecular formula C22H22FNO4S and molecular weight 415.13 g/mol. IUPAC: propan-2-yl 2-[(2,5-dimethylfuran-3-carbonyl)amino]-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate.
Chemical Property Profile of isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate
Property Insights of isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate
The XLogP value of 5.88996 indicates that isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.54 Ų falls within the moderate polarity range, balancing permeability and solubility for isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate?
The CAS number of isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate is 445232-33-7.
What is the molecular formula of isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate?
The molecular formula of isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate is C22H22FNO4S.
What is the molecular weight of isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate?
The molecular weight of isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate is 415.13 g/mol.
Where can I buy isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate?
You can request a quote for isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-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 isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for isopropyl 2-(2,5-dimethylfuran-3-carboxamido)-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.