F0653-0317
TL;DR: F0653-0317 (CAS 852144-99-1) is a chemical compound with molecular formula C22H22FN5O2S and molecular weight 439.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-fluorophenyl)methyl]-2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: F0653-0317, 2-((5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-fluorobenzyl)acetamide, N-[(4-fluorophenyl)methyl]-2-{[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-[(4-fluorophenyl)methyl]-2-[[(5Z)-5-indol-3-ylidene-4-(2-methoxyethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-[(4-fluorophenyl)methyl]-2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C22H22FN5O2S |
|---|---|
| Molecular Weight | 439.15 g/mol |
| LogP | 3.6204 |
| Topological Polar Surface Area | 84.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 439.14783 |
| Heavy Atoms | 31 |
| Complexity | 1172.3394 |
Chemical Identifiers
| CAS Number | 852144-99-1 |
|---|---|
| SMILES | COCCN1C(=NN=C1SCC(=O)NCC2=CC=C(C=C2)F)C3=CNC4=CC=CC=C43 |
Product Overview
F0653-0317 (CAS 852144-99-1), with molecular formula C22H22FN5O2S and molecular weight 439.15 g/mol. IUPAC: N-[(4-fluorophenyl)methyl]-2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of F0653-0317
Property Insights of F0653-0317
The XLogP value of 3.6204 indicates that F0653-0317 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.83 Ų falls within the moderate polarity range, balancing permeability and solubility for F0653-0317. Following Lipinski's Rule of Five, F0653-0317 has 2 hydrogen bond donor(s) and 5 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 F0653-0317?
The CAS number of F0653-0317 is 852144-99-1.
What is the molecular formula of F0653-0317?
The molecular formula of F0653-0317 is C22H22FN5O2S.
What is the molecular weight of F0653-0317?
The molecular weight of F0653-0317 is 439.15 g/mol.
Where can I buy F0653-0317?
You can request a quote for F0653-0317 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0653-0317?
Yes, KEHONG BIO provides custom synthesis services for F0653-0317 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.