F0417-0951
TL;DR: F0417-0951 (CAS 392298-62-3) is a chemical compound with molecular formula C21H21FN4O2S2 and molecular weight 444.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: F0417-0951, 4-tert-butyl-N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide, 4-(tert-butyl)-N-(5-((2-((2-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide, 4-tert-butyl-N-[5-({[(2-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide, N-[5-[(2-fluorophenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-tert-butyl-benzamide
| Molecular Formula | C21H21FN4O2S2 |
|---|---|
| Molecular Weight | 444.11 g/mol |
| LogP | 4.9578 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.109 |
| Heavy Atoms | 30 |
| Complexity | 1045.6599 |
Chemical Identifiers
| CAS Number | 392298-62-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC=C3F |
Product Overview
F0417-0951 (CAS 392298-62-3), with molecular formula C21H21FN4O2S2 and molecular weight 444.11 g/mol. IUPAC: 4-tert-butyl-N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of F0417-0951
Property Insights of F0417-0951
The XLogP value of 4.9578 indicates that F0417-0951 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 F0417-0951. Following Lipinski's Rule of Five, F0417-0951 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 F0417-0951?
The CAS number of F0417-0951 is 392298-62-3.
What is the molecular formula of F0417-0951?
The molecular formula of F0417-0951 is C21H21FN4O2S2.
What is the molecular weight of F0417-0951?
The molecular weight of F0417-0951 is 444.11 g/mol.
Where can I buy F0417-0951?
You can request a quote for F0417-0951 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0951?
Yes, KEHONG BIO provides custom synthesis services for F0417-0951 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.