F6548-4256
TL;DR: F6548-4256 (CAS 422525-64-2) is a chemical compound with molecular formula C28H22N4O4S3 and molecular weight 574.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-[[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: F6548-4256, methyl 2-(2-{[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamido)benzoate, methyl 2-(2-((7-oxo-6-phenyl-2-thioxo-3-(o-tolyl)-2,3,6,7-tetrahydrothiazolo[4,5-d]pyrimidin-5-yl)thio)acetamido)benzoate, methyl 2-[[2-[[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]acetyl]amino]benzoate
| Molecular Formula | C28H22N4O4S3 |
|---|---|
| Molecular Weight | 574.08 g/mol |
| LogP | 5.79321 |
| Topological Polar Surface Area | 95.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 574.0803 |
| Heavy Atoms | 39 |
| Complexity | 1826.6838 |
Chemical Identifiers
| CAS Number | 422525-64-2 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C3=C(C(=O)N(C(=N3)SCC(=O)NC4=CC=CC=C4C(=O)OC)C5=CC=CC=C5)SC2=S |
Product Overview
F6548-4256 (CAS 422525-64-2), with molecular formula C28H22N4O4S3 and molecular weight 574.08 g/mol. IUPAC: methyl 2-[[2-[[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F6548-4256
Property Insights of F6548-4256
The XLogP value of 5.79321 indicates that F6548-4256 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.22 Ų falls within the moderate polarity range, balancing permeability and solubility for F6548-4256. Following Lipinski's Rule of Five, F6548-4256 has 1 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 F6548-4256?
The CAS number of F6548-4256 is 422525-64-2.
What is the molecular formula of F6548-4256?
The molecular formula of F6548-4256 is C28H22N4O4S3.
What is the molecular weight of F6548-4256?
The molecular weight of F6548-4256 is 574.08 g/mol.
Where can I buy F6548-4256?
You can request a quote for F6548-4256 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F6548-4256?
Yes, KEHONG BIO provides custom synthesis services for F6548-4256 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.