F0837-0514
TL;DR: F0837-0514 (CAS 477298-40-1) is a chemical compound with molecular formula C21H11FN4O4S and molecular weight 434.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-fluoro-2-nitroanilino)-2-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: F0837-0514, (E)-3-((4-fluoro-2-nitrophenyl)amino)-2-(4-(2-oxo-2H-chromen-3-yl)thiazol-2-yl)acrylonitrile, (E)-3-(4-fluoro-2-nitroanilino)-2-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile, (2E)-3-[(4-fluoro-2-nitrophenyl)amino]-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile, 3-((4-Fluoro-2-nitrophenyl)amino)-2-(4-(2-oxo-2H-chromen-3-yl)thiazol-2-yl)acrylonitrile
| Molecular Formula | C21H11FN4O4S |
|---|---|
| Molecular Weight | 434.05 g/mol |
| LogP | 4.94038 |
| Topological Polar Surface Area | 122.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 434.0485 |
| Heavy Atoms | 31 |
| Complexity | 1451.7848 |
Chemical Identifiers
| CAS Number | 477298-40-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)/C(=C/NC4=C(C=C(C=C4)F)[N+](=O)[O-])/C#N |
Product Overview
F0837-0514 (CAS 477298-40-1), with molecular formula C21H11FN4O4S and molecular weight 434.05 g/mol. IUPAC: (E)-3-(4-fluoro-2-nitroanilino)-2-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of F0837-0514
Property Insights of F0837-0514
The XLogP value of 4.94038 indicates that F0837-0514 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.06 Ų falls within the moderate polarity range, balancing permeability and solubility for F0837-0514. Following Lipinski's Rule of Five, F0837-0514 has 1 hydrogen bond donor(s) and 8 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 F0837-0514?
The CAS number of F0837-0514 is 477298-40-1.
What is the molecular formula of F0837-0514?
The molecular formula of F0837-0514 is C21H11FN4O4S.
What is the molecular weight of F0837-0514?
The molecular weight of F0837-0514 is 434.05 g/mol.
Where can I buy F0837-0514?
You can request a quote for F0837-0514 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0837-0514?
Yes, KEHONG BIO provides custom synthesis services for F0837-0514 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.