F1421-0078
TL;DR: F1421-0078 (CAS 500203-16-7) is a chemical compound with molecular formula C21H18BrN3O4S and molecular weight 487.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[5-[2-(4-bromoanilino)-2-oxoethyl]-4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]amino]benzoic acid
Also Known As: F1421-0078, (E)-4-((3-allyl-5-(2-((4-bromophenyl)amino)-2-oxoethyl)-4-oxothiazolidin-2-ylidene)amino)benzoic acid, 4-{[(2E)-5-{[(4-BROMOPHENYL)CARBAMOYL]METHYL}-4-OXO-3-(PROP-2-EN-1-YL)-1,3-THIAZOLIDIN-2-YLIDENE]AMINO}BENZOIC ACID, 4-[[5-[2-(4-bromoanilino)-2-oxoethyl]-4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]amino]benzoic acid, 4-((3-Allyl-5-(2-((4-bromophenyl)amino)-2-oxoethyl)-4-oxothiazolidin-2-ylidene)amino)benzoic acid
| Molecular Formula | C21H18BrN3O4S |
|---|---|
| Molecular Weight | 487.02 g/mol |
| LogP | 4.2936 |
| Topological Polar Surface Area | 99.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 487.02014 |
| Heavy Atoms | 30 |
| Complexity | 1005.9165 |
Chemical Identifiers
| CAS Number | 500203-16-7 |
|---|---|
| SMILES | C=CCN1C(=O)C(SC1=NC2=CC=C(C=C2)C(=O)O)CC(=O)NC3=CC=C(C=C3)Br |
Product Overview
F1421-0078 (CAS 500203-16-7), with molecular formula C21H18BrN3O4S and molecular weight 487.02 g/mol. IUPAC: 4-[[5-[2-(4-bromoanilino)-2-oxoethyl]-4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]amino]benzoic acid.
Chemical Property Profile of F1421-0078
Property Insights of F1421-0078
The XLogP value of 4.2936 indicates that F1421-0078 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.07 Ų falls within the moderate polarity range, balancing permeability and solubility for F1421-0078. Following Lipinski's Rule of Five, F1421-0078 has 2 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 F1421-0078?
The CAS number of F1421-0078 is 500203-16-7.
What is the molecular formula of F1421-0078?
The molecular formula of F1421-0078 is C21H18BrN3O4S.
What is the molecular weight of F1421-0078?
The molecular weight of F1421-0078 is 487.02 g/mol.
Where can I buy F1421-0078?
You can request a quote for F1421-0078 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1421-0078?
Yes, KEHONG BIO provides custom synthesis services for F1421-0078 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.