F0837-0629
TL;DR: F0837-0629 (CAS 477305-22-9) is a chemical compound with molecular formula C19H10ClF3N4O2S and molecular weight 450.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[4-chloro-3-(trifluoromethyl)anilino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: F0837-0629, (2E)-3-{[4-chloro-3-(trifluoromethyl)phenyl]amino}-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile, (E)-3-((4-chloro-3-(trifluoromethyl)phenyl)amino)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile, (E)-3-[4-chloro-3-(trifluoromethyl)anilino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
| Molecular Formula | C19H10ClF3N4O2S |
|---|---|
| Molecular Weight | 450.02 g/mol |
| LogP | 6.36708 |
| Topological Polar Surface Area | 91.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 450.0165 |
| Heavy Atoms | 30 |
| Complexity | 1167.758 |
Chemical Identifiers
| CAS Number | 477305-22-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CSC(=N2)/C(=C/NC3=CC(=C(C=C3)Cl)C(F)(F)F)/C#N)[N+](=O)[O-] |
Product Overview
F0837-0629 (CAS 477305-22-9), with molecular formula C19H10ClF3N4O2S and molecular weight 450.02 g/mol. IUPAC: (E)-3-[4-chloro-3-(trifluoromethyl)anilino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of F0837-0629
Property Insights of F0837-0629
The XLogP value of 6.36708 indicates that F0837-0629 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.85 Ų falls within the moderate polarity range, balancing permeability and solubility for F0837-0629. Following Lipinski's Rule of Five, F0837-0629 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0837-0629?
The CAS number of F0837-0629 is 477305-22-9.
What is the molecular formula of F0837-0629?
The molecular formula of F0837-0629 is C19H10ClF3N4O2S.
What is the molecular weight of F0837-0629?
The molecular weight of F0837-0629 is 450.02 g/mol.
Where can I buy F0837-0629?
You can request a quote for F0837-0629 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0837-0629?
Yes, KEHONG BIO provides custom synthesis services for F0837-0629 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.