F0785-0079
TL;DR: F0785-0079 (CAS 477488-44-1) is a chemical compound with molecular formula C20H22FN3O4S2 and molecular weight 451.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-[(5E)-5-[(2-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl]piperazine-1-carboxylate
Also Known As: F0785-0079, (E)-ethyl 4-(3-(5-(2-fluorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoyl)piperazine-1-carboxylate, ETHYL 4-{3-[(5E)-5-[(2-FLUOROPHENYL)METHYLIDENE]-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]PROPANOYL}PIPERAZINE-1-CARBOXYLATE, ethyl 4-[3-[(5E)-5-[(2-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl]piperazine-1-carboxylate, ethyl 4-(3-{5-[(2-fluorophenyl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl} propanoyl)piperazinecarboxylate
| Molecular Formula | C20H22FN3O4S2 |
|---|---|
| Molecular Weight | 451.10 g/mol |
| LogP | 2.7177 |
| Topological Polar Surface Area | 70.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 451.10358 |
| Heavy Atoms | 30 |
| Complexity | 884.5575 |
Chemical Identifiers
| CAS Number | 477488-44-1 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CCN2C(=O)/C(=C\C3=CC=CC=C3F)/SC2=S |
Product Overview
F0785-0079 (CAS 477488-44-1), with molecular formula C20H22FN3O4S2 and molecular weight 451.10 g/mol. IUPAC: ethyl 4-[3-[(5E)-5-[(2-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl]piperazine-1-carboxylate.
Chemical Property Profile of F0785-0079
Property Insights of F0785-0079
The XLogP value of 2.7177 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0785-0079. The TPSA of 70.16 Ų falls within the moderate polarity range, balancing permeability and solubility for F0785-0079. Following Lipinski's Rule of Five, F0785-0079 has 0 hydrogen bond donor(s) and 6 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 F0785-0079?
The CAS number of F0785-0079 is 477488-44-1.
What is the molecular formula of F0785-0079?
The molecular formula of F0785-0079 is C20H22FN3O4S2.
What is the molecular weight of F0785-0079?
The molecular weight of F0785-0079 is 451.10 g/mol.
Where can I buy F0785-0079?
You can request a quote for F0785-0079 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0785-0079?
Yes, KEHONG BIO provides custom synthesis services for F0785-0079 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.