F0417-0854
TL;DR: F0417-0854 (CAS 392297-56-2) is a chemical compound with molecular formula C17H12ClFN4O2S2 and molecular weight 422.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: F0417-0854, 3-chloro-N-(5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide, 3-chloro-N-[5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide, 3-chloro-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide, 3-chloro-N-[5-[(4-fluorophenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C17H12ClFN4O2S2 |
|---|---|
| Molecular Weight | 422.01 g/mol |
| LogP | 4.3137 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 422.00742 |
| Heavy Atoms | 27 |
| Complexity | 965.5771 |
Chemical Identifiers
| CAS Number | 392297-56-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)F |
Product Overview
F0417-0854 (CAS 392297-56-2), with molecular formula C17H12ClFN4O2S2 and molecular weight 422.01 g/mol. IUPAC: 3-chloro-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of F0417-0854
Property Insights of F0417-0854
The XLogP value of 4.3137 indicates that F0417-0854 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 F0417-0854. Following Lipinski's Rule of Five, F0417-0854 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 F0417-0854?
The CAS number of F0417-0854 is 392297-56-2.
What is the molecular formula of F0417-0854?
The molecular formula of F0417-0854 is C17H12ClFN4O2S2.
What is the molecular weight of F0417-0854?
The molecular weight of F0417-0854 is 422.01 g/mol.
Where can I buy F0417-0854?
You can request a quote for F0417-0854 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0854?
Yes, KEHONG BIO provides custom synthesis services for F0417-0854 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.