F3394-0586
TL;DR: F3394-0586 (CAS 690960-30-6) is a chemical compound with molecular formula C25H20FN5O2S and molecular weight 473.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-5-phenyl-1H-pyrazolo[5,4-d]pyrimidin-4-one
Also Known As: F3394-0586, 6-((2-(1-(2-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxoethyl)thio)-5-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one, 6-[2-[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-5-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-one, 6-({2-[1-(2-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl}sulfanyl)-5-phenyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one, 6-{2-[1-(o-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethylthio}-5-phenyl-1,2,5,7-tetraaza-1,5-dihydro-4H-inden-4-one
| Molecular Formula | C25H20FN5O2S |
|---|---|
| Molecular Weight | 473.13 g/mol |
| LogP | 4.63044 |
| Topological Polar Surface Area | 85.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 473.13217 |
| Heavy Atoms | 34 |
| Complexity | 1586.4645 |
Chemical Identifiers
| CAS Number | 690960-30-6 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=CC=C2F)C)C(=O)CSC3=NC4=C(C=NN4)C(=O)N3C5=CC=CC=C5 |
Product Overview
F3394-0586 (CAS 690960-30-6), with molecular formula C25H20FN5O2S and molecular weight 473.13 g/mol. IUPAC: 6-[2-[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-5-phenyl-1H-pyrazolo[5,4-d]pyrimidin-4-one.
Chemical Property Profile of F3394-0586
Property Insights of F3394-0586
The XLogP value of 4.63044 indicates that F3394-0586 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.57 Ų falls within the moderate polarity range, balancing permeability and solubility for F3394-0586. Following Lipinski's Rule of Five, F3394-0586 has 1 hydrogen bond donor(s) and 5 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 F3394-0586?
The CAS number of F3394-0586 is 690960-30-6.
What is the molecular formula of F3394-0586?
The molecular formula of F3394-0586 is C25H20FN5O2S.
What is the molecular weight of F3394-0586?
The molecular weight of F3394-0586 is 473.13 g/mol.
Where can I buy F3394-0586?
You can request a quote for F3394-0586 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-0586?
Yes, KEHONG BIO provides custom synthesis services for F3394-0586 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.