F0653-0029
TL;DR: F0653-0029 (CAS 852142-80-4) is a chemical compound with molecular formula C21H21N5OS and molecular weight 391.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dimethylphenyl)-2-[[5-(1H-indol-3-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: F0653-0029, 2-((5-(1H-indol-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(2,4-dimethylphenyl)acetamide, N-(2,4-dimethylphenyl)-2-[[5-(1H-indol-3-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(2,4-dimethylphenyl)-2-{[5-(1H-indol-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2,4-dimethylphenyl)-2-[(5-indol-3-ylidene-4-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide
| Molecular Formula | C21H21N5OS |
|---|---|
| Molecular Weight | 391.15 g/mol |
| LogP | 4.31104 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.14667 |
| Heavy Atoms | 28 |
| Complexity | 1160.7849 |
Chemical Identifiers
| CAS Number | 852142-80-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CNC4=CC=CC=C43)C |
Product Overview
F0653-0029 (CAS 852142-80-4), with molecular formula C21H21N5OS and molecular weight 391.15 g/mol. IUPAC: N-(2,4-dimethylphenyl)-2-[[5-(1H-indol-3-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of F0653-0029
Property Insights of F0653-0029
The XLogP value of 4.31104 indicates that F0653-0029 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for F0653-0029. Following Lipinski's Rule of Five, F0653-0029 has 2 hydrogen bond donor(s) and 4 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 F0653-0029?
The CAS number of F0653-0029 is 852142-80-4.
What is the molecular formula of F0653-0029?
The molecular formula of F0653-0029 is C21H21N5OS.
What is the molecular weight of F0653-0029?
The molecular weight of F0653-0029 is 391.15 g/mol.
Where can I buy F0653-0029?
You can request a quote for F0653-0029 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0653-0029?
Yes, KEHONG BIO provides custom synthesis services for F0653-0029 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.