F0417-0868
TL;DR: F0417-0868 (CAS 392297-70-0) is a chemical compound with molecular formula C18H12F4N4O2S2 and molecular weight 456.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide
Also Known As: F0417-0868, N-(5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-(trifluoromethyl)benzamide, N-[5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide, N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide, N-[5-[(4-fluorophenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide
| Molecular Formula | C18H12F4N4O2S2 |
|---|---|
| Molecular Weight | 456.03 g/mol |
| LogP | 4.6791 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 456.03378 |
| Heavy Atoms | 30 |
| Complexity | 1054.84 |
Chemical Identifiers
| CAS Number | 392297-70-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)F |
Product Overview
F0417-0868 (CAS 392297-70-0), with molecular formula C18H12F4N4O2S2 and molecular weight 456.03 g/mol. IUPAC: N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide.
Chemical Property Profile of F0417-0868
Property Insights of F0417-0868
The XLogP value of 4.6791 indicates that F0417-0868 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 F0417-0868. Following Lipinski's Rule of Five, F0417-0868 has 2 hydrogen bond donor(s) and 6 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 F0417-0868?
The CAS number of F0417-0868 is 392297-70-0.
What is the molecular formula of F0417-0868?
The molecular formula of F0417-0868 is C18H12F4N4O2S2.
What is the molecular weight of F0417-0868?
The molecular weight of F0417-0868 is 456.03 g/mol.
Where can I buy F0417-0868?
You can request a quote for F0417-0868 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0868?
Yes, KEHONG BIO provides custom synthesis services for F0417-0868 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.