F0594-0504
TL;DR: F0594-0504 (CAS 460732-97-2) is a chemical compound with molecular formula C21H21N3O5S and molecular weight 427.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydroindol-1-yl)-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
Also Known As: F0594-0504, 1-(2,3-dihydro-1H-indol-1-yl)-2-{[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one, 1-(2,3-dihydroindol-1-yl)-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone, 1-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio}acetyl)indoline, 1-(indolin-1-yl)-2-((5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl)thio)ethanone
| Molecular Formula | C21H21N3O5S |
|---|---|
| Molecular Weight | 427.12 g/mol |
| LogP | 3.4438 |
| Topological Polar Surface Area | 86.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 427.12018 |
| Heavy Atoms | 30 |
| Complexity | 1043.2954 |
Chemical Identifiers
| CAS Number | 460732-97-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)SCC(=O)N3CCC4=CC=CC=C43 |
Product Overview
F0594-0504 (CAS 460732-97-2), with molecular formula C21H21N3O5S and molecular weight 427.12 g/mol. IUPAC: 1-(2,3-dihydroindol-1-yl)-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone.
Chemical Property Profile of F0594-0504
Property Insights of F0594-0504
The XLogP value of 3.4438 indicates that F0594-0504 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.92 Ų falls within the moderate polarity range, balancing permeability and solubility for F0594-0504. Following Lipinski's Rule of Five, F0594-0504 has 0 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 F0594-0504?
The CAS number of F0594-0504 is 460732-97-2.
What is the molecular formula of F0594-0504?
The molecular formula of F0594-0504 is C21H21N3O5S.
What is the molecular weight of F0594-0504?
The molecular weight of F0594-0504 is 427.12 g/mol.
Where can I buy F0594-0504?
You can request a quote for F0594-0504 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0594-0504?
Yes, KEHONG BIO provides custom synthesis services for F0594-0504 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.