F1726-0071
TL;DR: F1726-0071 (CAS 868152-72-1) is a chemical compound with molecular formula C14H16N4O2S2 and molecular weight 336.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[[3-[2-(2-methylanilino)-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-yl]methyl] ethanethioate
Also Known As: F1726-0071, 2-({3-[(acetylsulfanyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)-N-(2-methylphenyl)acetamide, 2-[3-(acetylthiomethyl)(1H-1,2,4-triazol-5-ylthio)]-N-(2-methylphenyl)acetamid e, S-[[3-[2-(2-methylanilino)-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-yl]methyl] ethanethioate, C-methyl {5-[(N-o-tolylcarbamoyl)methylthio]-1H-1,2,4-triazol-3-yl}ethanethioate
| Molecular Formula | C14H16N4O2S2 |
|---|---|
| Molecular Weight | 336.07 g/mol |
| LogP | 2.62362 |
| Topological Polar Surface Area | 87.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.07147 |
| Heavy Atoms | 22 |
| Complexity | 672.3674 |
Chemical Identifiers
| CAS Number | 868152-72-1 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CSC2=NNC(=N2)CSC(=O)C |
Product Overview
F1726-0071 (CAS 868152-72-1), with molecular formula C14H16N4O2S2 and molecular weight 336.07 g/mol. IUPAC: S-[[3-[2-(2-methylanilino)-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-yl]methyl] ethanethioate.
Chemical Property Profile of F1726-0071
Property Insights of F1726-0071
The XLogP value of 2.62362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1726-0071. The TPSA of 87.74 Ų falls within the moderate polarity range, balancing permeability and solubility for F1726-0071. Following Lipinski's Rule of Five, F1726-0071 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 F1726-0071?
The CAS number of F1726-0071 is 868152-72-1.
What is the molecular formula of F1726-0071?
The molecular formula of F1726-0071 is C14H16N4O2S2.
What is the molecular weight of F1726-0071?
The molecular weight of F1726-0071 is 336.07 g/mol.
Where can I buy F1726-0071?
You can request a quote for F1726-0071 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1726-0071?
Yes, KEHONG BIO provides custom synthesis services for F1726-0071 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.