F0579-0596
TL;DR: F0579-0596 (CAS 687562-83-0) is a chemical compound with molecular formula C19H14ClFN2OS2 and molecular weight 404.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methylsulfanyl]-3-(4-fluorophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one
Also Known As: F0579-0596, 2-{[(4-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-4-one, 2-((4-chlorobenzyl)thio)-3-(4-fluorophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one, 2-[(4-chlorophenyl)methylsulfanyl]-3-(4-fluorophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one
| Molecular Formula | C19H14ClFN2OS2 |
|---|---|
| Molecular Weight | 404.02 g/mol |
| LogP | 4.9655 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.022 |
| Heavy Atoms | 26 |
| Complexity | 1003.78796 |
Chemical Identifiers
| CAS Number | 687562-83-0 |
|---|---|
| SMILES | C1CSC2=C1N=C(N(C2=O)C3=CC=C(C=C3)F)SCC4=CC=C(C=C4)Cl |
Product Overview
F0579-0596 (CAS 687562-83-0), with molecular formula C19H14ClFN2OS2 and molecular weight 404.02 g/mol. IUPAC: 2-[(4-chlorophenyl)methylsulfanyl]-3-(4-fluorophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one.
Chemical Property Profile of F0579-0596
Property Insights of F0579-0596
The XLogP value of 4.9655 indicates that F0579-0596 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, F0579-0596 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0579-0596 has 0 hydrogen bond donor(s) and 4 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 F0579-0596?
The CAS number of F0579-0596 is 687562-83-0.
What is the molecular formula of F0579-0596?
The molecular formula of F0579-0596 is C19H14ClFN2OS2.
What is the molecular weight of F0579-0596?
The molecular weight of F0579-0596 is 404.02 g/mol.
Where can I buy F0579-0596?
You can request a quote for F0579-0596 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0579-0596?
Yes, KEHONG BIO provides custom synthesis services for F0579-0596 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.