F0417-1780
TL;DR: F0417-1780 (CAS 392301-69-8) is a chemical compound with molecular formula C17H11BrF3N3OS2 and molecular weight 472.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: F0417-1780, 3-bromo-N-[5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide, 3-bromo-N-[5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide, 3-bromo-N-(5-((4-(trifluoromethyl)benzyl)thio)-1,3,4-thiadiazol-2-yl)benzamide
| Molecular Formula | C17H11BrF3N3OS2 |
|---|---|
| Molecular Weight | 472.95 g/mol |
| LogP | 5.864 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 472.9479 |
| Heavy Atoms | 27 |
| Complexity | 945.09674 |
Chemical Identifiers
| CAS Number | 392301-69-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)C(F)(F)F |
Product Overview
F0417-1780 (CAS 392301-69-8), with molecular formula C17H11BrF3N3OS2 and molecular weight 472.95 g/mol. IUPAC: 3-bromo-N-[5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of F0417-1780
Property Insights of F0417-1780
The XLogP value of 5.864 indicates that F0417-1780 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, F0417-1780 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0417-1780 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0417-1780?
The CAS number of F0417-1780 is 392301-69-8.
What is the molecular formula of F0417-1780?
The molecular formula of F0417-1780 is C17H11BrF3N3OS2.
What is the molecular weight of F0417-1780?
The molecular weight of F0417-1780 is 472.95 g/mol.
Where can I buy F0417-1780?
You can request a quote for F0417-1780 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-1780?
Yes, KEHONG BIO provides custom synthesis services for F0417-1780 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.