F0594-0060
TL;DR: F0594-0060 (CAS 850936-74-2) is a chemical compound with molecular formula C18H22N4O4S and molecular weight 390.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]piperazine-1-carboxylate
Also Known As: F0594-0060, ethyl 4-(2-((5-(m-tolyl)-1,3,4-oxadiazol-2-yl)thio)acetyl)piperazine-1-carboxylate, ETHYL 4-(2-{[5-(3-METHYLPHENYL)-1,3,4-OXADIAZOL-2-YL]SULFANYL}ACETYL)PIPERAZINE-1-CARBOXYLATE, ethyl 4-[2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]piperazine-1-carboxylate
| Molecular Formula | C18H22N4O4S |
|---|---|
| Molecular Weight | 390.14 g/mol |
| LogP | 2.43782 |
| Topological Polar Surface Area | 88.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.13617 |
| Heavy Atoms | 27 |
| Complexity | 802.16425 |
Chemical Identifiers
| CAS Number | 850936-74-2 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CSC2=NN=C(O2)C3=CC=CC(=C3)C |
Product Overview
F0594-0060 (CAS 850936-74-2), with molecular formula C18H22N4O4S and molecular weight 390.14 g/mol. IUPAC: ethyl 4-[2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]piperazine-1-carboxylate.
Chemical Property Profile of F0594-0060
Property Insights of F0594-0060
The XLogP value of 2.43782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0594-0060. The TPSA of 88.77 Ų falls within the moderate polarity range, balancing permeability and solubility for F0594-0060. Following Lipinski's Rule of Five, F0594-0060 has 0 hydrogen bond donor(s) and 7 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 F0594-0060?
The CAS number of F0594-0060 is 850936-74-2.
What is the molecular formula of F0594-0060?
The molecular formula of F0594-0060 is C18H22N4O4S.
What is the molecular weight of F0594-0060?
The molecular weight of F0594-0060 is 390.14 g/mol.
Where can I buy F0594-0060?
You can request a quote for F0594-0060 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0594-0060?
Yes, KEHONG BIO provides custom synthesis services for F0594-0060 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.