F0864-0007
TL;DR: F0864-0007 (CAS 327094-53-1) is a chemical compound with molecular formula C22H22N4O2S3 and molecular weight 470.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanoate
Also Known As: F0864-0007, ethyl 4-({5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)butanoate, ethyl 4-((5-((benzo[d]thiazol-2-ylthio)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)butanoate, ethyl 4-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanoate, Ethyl 4-[[5-(benzothiazol-2-ylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanoate
| Molecular Formula | C22H22N4O2S3 |
|---|---|
| Molecular Weight | 470.09 g/mol |
| LogP | 5.6047 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 470.09048 |
| Heavy Atoms | 31 |
| Complexity | 1111.092 |
Chemical Identifiers
| CAS Number | 327094-53-1 |
|---|---|
| SMILES | CCOC(=O)CCCSC1=NN=C(N1C2=CC=CC=C2)CSC3=NC4=CC=CC=C4S3 |
Product Overview
F0864-0007 (CAS 327094-53-1), with molecular formula C22H22N4O2S3 and molecular weight 470.09 g/mol. IUPAC: ethyl 4-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanoate.
Chemical Property Profile of F0864-0007
Property Insights of F0864-0007
The XLogP value of 5.6047 indicates that F0864-0007 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for F0864-0007. Following Lipinski's Rule of Five, F0864-0007 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0864-0007?
The CAS number of F0864-0007 is 327094-53-1.
What is the molecular formula of F0864-0007?
The molecular formula of F0864-0007 is C22H22N4O2S3.
What is the molecular weight of F0864-0007?
The molecular weight of F0864-0007 is 470.09 g/mol.
Where can I buy F0864-0007?
You can request a quote for F0864-0007 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0864-0007?
Yes, KEHONG BIO provides custom synthesis services for F0864-0007 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.