F0601-0020
TL;DR: F0601-0020 (CAS 689747-45-3) is a chemical compound with molecular formula C22H23FN4O3S and molecular weight 442.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[5-[[(2-fluorobenzoyl)amino]methyl]-4-(2-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate
Also Known As: F0601-0020, ethyl 2-((5-((2-fluorobenzamido)methyl)-4-phenethyl-4H-1,2,4-triazol-3-yl)thio)acetate, ethyl 2-[(5-{[(2-fluorophenyl)formamido]methyl}-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl)sulfanyl]acetate, Ethyl 2-[[5-[[(2-fluorobenzoyl)amino]methyl]-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]acetate, ethyl {5-[(o-fluorobenzylamino)methyl]-4-phenethyl-4H-1,2,4-triazol-3-ylthio}acetate
| Molecular Formula | C22H23FN4O3S |
|---|---|
| Molecular Weight | 442.15 g/mol |
| LogP | 3.2451 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 442.1475 |
| Heavy Atoms | 31 |
| Complexity | 1026.6053 |
Chemical Identifiers
| CAS Number | 689747-45-3 |
|---|---|
| SMILES | CCOC(=O)CSC1=NN=C(N1CCC2=CC=CC=C2)CNC(=O)C3=CC=CC=C3F |
Product Overview
F0601-0020 (CAS 689747-45-3), with molecular formula C22H23FN4O3S and molecular weight 442.15 g/mol. IUPAC: ethyl 2-[[5-[[(2-fluorobenzoyl)amino]methyl]-4-(2-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate.
Chemical Property Profile of F0601-0020
Property Insights of F0601-0020
The XLogP value of 3.2451 indicates that F0601-0020 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for F0601-0020. Following Lipinski's Rule of Five, F0601-0020 has 1 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 F0601-0020?
The CAS number of F0601-0020 is 689747-45-3.
What is the molecular formula of F0601-0020?
The molecular formula of F0601-0020 is C22H23FN4O3S.
What is the molecular weight of F0601-0020?
The molecular weight of F0601-0020 is 442.15 g/mol.
Where can I buy F0601-0020?
You can request a quote for F0601-0020 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0601-0020?
Yes, KEHONG BIO provides custom synthesis services for F0601-0020 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.