![propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate structure](/static/products/4450/445007-52-3.webp)
propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate
TL;DR: propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate (CAS 445007-52-3) is a chemical compound with molecular formula C22H19FN2O6S and molecular weight 458.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate
Also Known As: propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate, isopropyl 4-(4-fluorophenyl)-2-[({4-nitrophenoxy}acetyl)amino]thiophene-3-carboxylate, methylethyl 4-(4-fluorophenyl)-2-[2-(4-nitrophenoxy)acetylamino]thiophene-3-ca rboxylate, propan-2-yl 4-(4-fluorophenyl)-2-{[(4-nitrophenoxy)acetyl]amino}thiophene-3-carboxylate
| Molecular Formula | C22H19FN2O6S |
|---|---|
| Molecular Weight | 458.09 g/mol |
| LogP | 5.0451 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 458.0948 |
| Heavy Atoms | 32 |
| Complexity | 1126.3278 |
Chemical Identifiers
| CAS Number | 445007-52-3 |
|---|---|
| SMILES | CC(C)OC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate (CAS 445007-52-3), with molecular formula C22H19FN2O6S and molecular weight 458.09 g/mol. IUPAC: propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate
Property Insights of propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate
The XLogP value of 5.0451 indicates that propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.77 Ų falls within the moderate polarity range, balancing permeability and solubility for propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate. Following Lipinski's Rule of Five, propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate?
The CAS number of propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate is 445007-52-3.
What is the molecular formula of propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate?
The molecular formula of propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate is C22H19FN2O6S.
What is the molecular weight of propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate?
The molecular weight of propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate is 458.09 g/mol.
Where can I buy propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate?
You can request a quote for propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.