F3077-1226
TL;DR: F3077-1226 (CAS 853740-71-3) is a chemical compound with molecular formula C22H19BrN2O3S and molecular weight 470.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-[5-[(3-bromophenyl)methyl]-3-(4-methylphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyanoacetate
Also Known As: F3077-1226, (Z)-ethyl 2-(5-(3-bromobenzyl)-4-oxo-3-(p-tolyl)thiazolidin-2-ylidene)-2-cyanoacetate, ETHYL 2-[(2Z)-5-[(3-BROMOPHENYL)METHYL]-3-(4-METHYLPHENYL)-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE]-2-CYANOACETATE, ethyl (2Z)-2-[5-[(3-bromophenyl)methyl]-3-(4-methylphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyanoacetate, ethyl (2Z)-[5-(3-bromobenzyl)-3-(4-methylphenyl)-4-oxo-1,3-thiazolidin-2-ylidene](cyano)ethanoate
| Molecular Formula | C22H19BrN2O3S |
|---|---|
| Molecular Weight | 470.03 g/mol |
| LogP | 4.7469 |
| Topological Polar Surface Area | 70.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.02997 |
| Heavy Atoms | 29 |
| Complexity | 1011.4626 |
Chemical Identifiers
| CAS Number | 853740-71-3 |
|---|---|
| SMILES | CCOC(=O)/C(=C\1/N(C(=O)C(S1)CC2=CC(=CC=C2)Br)C3=CC=C(C=C3)C)/C#N |
Product Overview
F3077-1226 (CAS 853740-71-3), with molecular formula C22H19BrN2O3S and molecular weight 470.03 g/mol. IUPAC: ethyl (2Z)-2-[5-[(3-bromophenyl)methyl]-3-(4-methylphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyanoacetate.
Chemical Property Profile of F3077-1226
Property Insights of F3077-1226
The XLogP value of 4.7469 indicates that F3077-1226 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.4 Ų falls within the moderate polarity range, balancing permeability and solubility for F3077-1226. Following Lipinski's Rule of Five, F3077-1226 has 0 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 F3077-1226?
The CAS number of F3077-1226 is 853740-71-3.
What is the molecular formula of F3077-1226?
The molecular formula of F3077-1226 is C22H19BrN2O3S.
What is the molecular weight of F3077-1226?
The molecular weight of F3077-1226 is 470.03 g/mol.
Where can I buy F3077-1226?
You can request a quote for F3077-1226 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3077-1226?
Yes, KEHONG BIO provides custom synthesis services for F3077-1226 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.