F0653-0319
TL;DR: F0653-0319 (CAS 852145-01-8) is a chemical compound with molecular formula C22H22ClN5O2S and molecular weight 455.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-chlorophenyl)methyl]-2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: F0653-0319, N-[(2-chlorophenyl)methyl]-2-{[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, 2-((5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-chlorobenzyl)acetamide, N-(o-chlorophenyl)methyl[5-(3-indolyl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-ylthio]acetamide, N-[(2-chlorophenyl)methyl]-2-[[(5Z)-5-indol-3-ylidene-4-(2-methoxyethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C22H22ClN5O2S |
|---|---|
| Molecular Weight | 455.12 g/mol |
| LogP | 4.1347 |
| Topological Polar Surface Area | 84.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 455.1183 |
| Heavy Atoms | 31 |
| Complexity | 1189.5894 |
Chemical Identifiers
| CAS Number | 852145-01-8 |
|---|---|
| SMILES | COCCN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2Cl)C3=CNC4=CC=CC=C43 |
Product Overview
F0653-0319 (CAS 852145-01-8), with molecular formula C22H22ClN5O2S and molecular weight 455.12 g/mol. IUPAC: N-[(2-chlorophenyl)methyl]-2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of F0653-0319
Property Insights of F0653-0319
The XLogP value of 4.1347 indicates that F0653-0319 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 F0653-0319. Following Lipinski's Rule of Five, F0653-0319 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 F0653-0319?
The CAS number of F0653-0319 is 852145-01-8.
What is the molecular formula of F0653-0319?
The molecular formula of F0653-0319 is C22H22ClN5O2S.
What is the molecular weight of F0653-0319?
The molecular weight of F0653-0319 is 455.12 g/mol.
Where can I buy F0653-0319?
You can request a quote for F0653-0319 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0653-0319?
Yes, KEHONG BIO provides custom synthesis services for F0653-0319 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.