F0601-0012
TL;DR: F0601-0012 (CAS 689747-19-1) is a chemical compound with molecular formula C22H23FN4O5S and molecular weight 474.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[5-[[(3,5-dimethoxybenzoyl)amino]methyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate
Also Known As: F0601-0012, ethyl 2-((5-((3,5-dimethoxybenzamido)methyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl)thio)acetate, ethyl 2-[(5-{[(3,5-dimethoxyphenyl)formamido]methyl}-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl)sulfanyl]acetate, ethyl 2-[[5-[[(3,5-dimethoxybenzoyl)amino]methyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate
| Molecular Formula | C22H23FN4O5S |
|---|---|
| Molecular Weight | 474.14 g/mol |
| LogP | 3.0088 |
| Topological Polar Surface Area | 104.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 474.13733 |
| Heavy Atoms | 33 |
| Complexity | 1098.224 |
Chemical Identifiers
| CAS Number | 689747-19-1 |
|---|---|
| SMILES | CCOC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)F)CNC(=O)C3=CC(=CC(=C3)OC)OC |
Product Overview
F0601-0012 (CAS 689747-19-1), with molecular formula C22H23FN4O5S and molecular weight 474.14 g/mol. IUPAC: ethyl 2-[[5-[[(3,5-dimethoxybenzoyl)amino]methyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate.
Chemical Property Profile of F0601-0012
Property Insights of F0601-0012
The XLogP value of 3.0088 indicates that F0601-0012 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.57 Ų falls within the moderate polarity range, balancing permeability and solubility for F0601-0012. Following Lipinski's Rule of Five, F0601-0012 has 1 hydrogen bond donor(s) and 8 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 F0601-0012?
The CAS number of F0601-0012 is 689747-19-1.
What is the molecular formula of F0601-0012?
The molecular formula of F0601-0012 is C22H23FN4O5S.
What is the molecular weight of F0601-0012?
The molecular weight of F0601-0012 is 474.14 g/mol.
Where can I buy F0601-0012?
You can request a quote for F0601-0012 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0601-0012?
Yes, KEHONG BIO provides custom synthesis services for F0601-0012 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.