F0653-0839
TL;DR: F0653-0839 (CAS 852167-70-5) is a chemical compound with molecular formula C22H17FN6OS2 and molecular weight 464.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-fluorophenyl)-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
Also Known As: F0653-0839, 2-{[4-(4-fluorophenyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-1,3-thiazol-2-yl)acetamide, 2-((4-(4-fluorophenyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-methylthiazol-2-yl)acetamide, 2-[[4-(4-fluorophenyl)-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide, 2-[[4-(4-fluorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
| Molecular Formula | C22H17FN6OS2 |
|---|---|
| Molecular Weight | 464.09 g/mol |
| LogP | 5.05042 |
| Topological Polar Surface Area | 88.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 464.08893 |
| Heavy Atoms | 32 |
| Complexity | 1405.6084 |
Chemical Identifiers
| CAS Number | 852167-70-5 |
|---|---|
| SMILES | CC1=CSC(=N1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)F)C4=CNC5=CC=CC=C54 |
Product Overview
F0653-0839 (CAS 852167-70-5), with molecular formula C22H17FN6OS2 and molecular weight 464.09 g/mol. IUPAC: 2-[[4-(4-fluorophenyl)-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of F0653-0839
Property Insights of F0653-0839
The XLogP value of 5.05042 indicates that F0653-0839 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.49 Ų falls within the moderate polarity range, balancing permeability and solubility for F0653-0839. Following Lipinski's Rule of Five, F0653-0839 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 F0653-0839?
The CAS number of F0653-0839 is 852167-70-5.
What is the molecular formula of F0653-0839?
The molecular formula of F0653-0839 is C22H17FN6OS2.
What is the molecular weight of F0653-0839?
The molecular weight of F0653-0839 is 464.09 g/mol.
Where can I buy F0653-0839?
You can request a quote for F0653-0839 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0653-0839?
Yes, KEHONG BIO provides custom synthesis services for F0653-0839 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.