F0579-0669
TL;DR: F0579-0669 (CAS 687564-72-3) is a chemical compound with molecular formula C19H14ClN3O3S2 and molecular weight 431.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one
Also Known As: F0579-0669, 3-(4-chlorophenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-4-one, 3-(4-chlorophenyl)-2-((4-nitrobenzyl)thio)-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one, 3-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one
| Molecular Formula | C19H14ClN3O3S2 |
|---|---|
| Molecular Weight | 431.02 g/mol |
| LogP | 4.7346 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.0165 |
| Heavy Atoms | 28 |
| Complexity | 1099.147 |
Chemical Identifiers
| CAS Number | 687564-72-3 |
|---|---|
| SMILES | C1CSC2=C1N=C(N(C2=O)C3=CC=C(C=C3)Cl)SCC4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
F0579-0669 (CAS 687564-72-3), with molecular formula C19H14ClN3O3S2 and molecular weight 431.02 g/mol. IUPAC: 3-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one.
Chemical Property Profile of F0579-0669
Property Insights of F0579-0669
The XLogP value of 4.7346 indicates that F0579-0669 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for F0579-0669. Following Lipinski's Rule of Five, F0579-0669 has 0 hydrogen bond donor(s) and 6 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 F0579-0669?
The CAS number of F0579-0669 is 687564-72-3.
What is the molecular formula of F0579-0669?
The molecular formula of F0579-0669 is C19H14ClN3O3S2.
What is the molecular weight of F0579-0669?
The molecular weight of F0579-0669 is 431.02 g/mol.
Where can I buy F0579-0669?
You can request a quote for F0579-0669 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0579-0669?
Yes, KEHONG BIO provides custom synthesis services for F0579-0669 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.