F0417-1006
TL;DR: F0417-1006 (CAS 392298-94-1) is a chemical compound with molecular formula C20H14ClF3N4O2S2 and molecular weight 498.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide
Also Known As: F0417-1006, (2E)-N-{5-[({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylprop-2-enamide, N-(5-((2-((2-chloro-5-(trifluoromethyl)phenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide, (E)-N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide, N-(5-{[N-2-chloro-5-(trifluoromethyl)phenylcarbamoyl]methylthio}-1,3,4-thiadiazol-2-yl)-(E)-cinnamamide
| Molecular Formula | C20H14ClF3N4O2S2 |
|---|---|
| Molecular Weight | 498.02 g/mol |
| LogP | 5.593 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 498.01987 |
| Heavy Atoms | 32 |
| Complexity | 1137.3735 |
Chemical Identifiers
| CAS Number | 392298-94-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)NC2=NN=C(S2)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl |
Product Overview
F0417-1006 (CAS 392298-94-1), with molecular formula C20H14ClF3N4O2S2 and molecular weight 498.02 g/mol. IUPAC: (E)-N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide.
Chemical Property Profile of F0417-1006
Property Insights of F0417-1006
The XLogP value of 5.593 indicates that F0417-1006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-1006. Following Lipinski's Rule of Five, F0417-1006 has 2 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 F0417-1006?
The CAS number of F0417-1006 is 392298-94-1.
What is the molecular formula of F0417-1006?
The molecular formula of F0417-1006 is C20H14ClF3N4O2S2.
What is the molecular weight of F0417-1006?
The molecular weight of F0417-1006 is 498.02 g/mol.
Where can I buy F0417-1006?
You can request a quote for F0417-1006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-1006?
Yes, KEHONG BIO provides custom synthesis services for F0417-1006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.