F0417-1741
TL;DR: F0417-1741 (CAS 392301-40-5) is a chemical compound with molecular formula C17H11F3N4O3S2 and molecular weight 440.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-N-[5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: F0417-1741, 3-nitro-N-[5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide, 3-nitro-N-[5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide, 3-nitro-N-(5-((4-(trifluoromethyl)benzyl)thio)-1,3,4-thiadiazol-2-yl)benzamide
| Molecular Formula | C17H11F3N4O3S2 |
|---|---|
| Molecular Weight | 440.02 g/mol |
| LogP | 5.0097 |
| Topological Polar Surface Area | 98.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.02246 |
| Heavy Atoms | 29 |
| Complexity | 1038.9025 |
Chemical Identifiers
| CAS Number | 392301-40-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)C(F)(F)F |
Product Overview
F0417-1741 (CAS 392301-40-5), with molecular formula C17H11F3N4O3S2 and molecular weight 440.02 g/mol. IUPAC: 3-nitro-N-[5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of F0417-1741
Property Insights of F0417-1741
The XLogP value of 5.0097 indicates that F0417-1741 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.02 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-1741. Following Lipinski's Rule of Five, F0417-1741 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0417-1741?
The CAS number of F0417-1741 is 392301-40-5.
What is the molecular formula of F0417-1741?
The molecular formula of F0417-1741 is C17H11F3N4O3S2.
What is the molecular weight of F0417-1741?
The molecular weight of F0417-1741 is 440.02 g/mol.
Where can I buy F0417-1741?
You can request a quote for F0417-1741 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-1741?
Yes, KEHONG BIO provides custom synthesis services for F0417-1741 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.