F0417-0776
TL;DR: F0417-0776 (CAS 392297-01-7) is a chemical compound with molecular formula C18H12BrF3N4O2S2 and molecular weight 515.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: F0417-0776, 4-bromo-N-(5-((2-oxo-2-((2-(trifluoromethyl)phenyl)amino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide, 4-bromo-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide, 4-bromo-N-{5-[({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide, 4-bromo-N-[5-[[2-(trifluoromethyl)phenyl]carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C18H12BrF3N4O2S2 |
|---|---|
| Molecular Weight | 515.95 g/mol |
| LogP | 5.3025 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 515.95374 |
| Heavy Atoms | 30 |
| Complexity | 1058.0851 |
Chemical Identifiers
| CAS Number | 392297-01-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)Br |
Product Overview
F0417-0776 (CAS 392297-01-7), with molecular formula C18H12BrF3N4O2S2 and molecular weight 515.95 g/mol. IUPAC: 4-bromo-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of F0417-0776
Property Insights of F0417-0776
The XLogP value of 5.3025 indicates that F0417-0776 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 F0417-0776. Following Lipinski's Rule of Five, F0417-0776 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 F0417-0776?
The CAS number of F0417-0776 is 392297-01-7.
What is the molecular formula of F0417-0776?
The molecular formula of F0417-0776 is C18H12BrF3N4O2S2.
What is the molecular weight of F0417-0776?
The molecular weight of F0417-0776 is 515.95 g/mol.
Where can I buy F0417-0776?
You can request a quote for F0417-0776 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0776?
Yes, KEHONG BIO provides custom synthesis services for F0417-0776 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.