F0594-0748
TL;DR: F0594-0748 (CAS 896676-04-3) is a chemical compound with molecular formula C24H25N3O6S2 and molecular weight 515.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F0594-0748, ethyl 2-(2-((5-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-1,3,4-oxadiazol-2-yl)thio)acetamido)-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-(2-{[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[[2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C24H25N3O6S2 |
|---|---|
| Molecular Weight | 515.12 g/mol |
| LogP | 4.6016 |
| Topological Polar Surface Area | 112.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 515.11847 |
| Heavy Atoms | 35 |
| Complexity | 1254.1129 |
Chemical Identifiers
| CAS Number | 896676-04-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)CSC3=NN=C(O3)C4=CC5=C(C=C4)OCCO5 |
Product Overview
F0594-0748 (CAS 896676-04-3), with molecular formula C24H25N3O6S2 and molecular weight 515.12 g/mol. IUPAC: ethyl 2-[[2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F0594-0748
Property Insights of F0594-0748
The XLogP value of 4.6016 indicates that F0594-0748 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.78 Ų falls within the moderate polarity range, balancing permeability and solubility for F0594-0748. Following Lipinski's Rule of Five, F0594-0748 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0594-0748?
The CAS number of F0594-0748 is 896676-04-3.
What is the molecular formula of F0594-0748?
The molecular formula of F0594-0748 is C24H25N3O6S2.
What is the molecular weight of F0594-0748?
The molecular weight of F0594-0748 is 515.12 g/mol.
Where can I buy F0594-0748?
You can request a quote for F0594-0748 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0594-0748?
Yes, KEHONG BIO provides custom synthesis services for F0594-0748 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.