F0579-0781
TL;DR: F0579-0781 (CAS 687567-34-6) is a chemical compound with molecular formula C18H19BrN2O3S2 and molecular weight 454.00204 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[[3-(4-bromophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-2-methylpropanoate
Also Known As: F0579-0781, ethyl 2-{[3-(4-bromophenyl)-4-oxo-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}-2-methylpropanoate, ethyl 2-((3-(4-bromophenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)-2-methylpropanoate, ethyl 2-[[3-(4-bromophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-2-methylpropanoate
Technical Specifications
| Molecular Formula | C18H19BrN2O3S2 |
| Molecular Weight | 454.00204 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.00204 Da |
| Heavy Atoms | 26 |
| Complexity | 655.0 |
| SMILES | CCOC(=O)C(C)(C)SC1=NC2=C(C(=O)N1C3=CC=C(C=C3)Br)SCC2 |
| InChIKey | QLLZIOBEIPNORT-UHFFFAOYSA-N |
Chemical Property Profile of F0579-0781
Property Insights of F0579-0781
The XLogP value of 4.3 indicates that F0579-0781 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for F0579-0781. Following Lipinski's Rule of Five, F0579-0781 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
What is the CAS number of F0579-0781?
The CAS number of F0579-0781 is 687567-34-6.
What is the molecular formula of F0579-0781?
The molecular formula of F0579-0781 is C18H19BrN2O3S2.
What is the molecular weight of F0579-0781?
The molecular weight of F0579-0781 is 454.00204 g/mol.
Where can I buy F0579-0781?
You can request a quote for F0579-0781 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F0579-0781?
Yes, CoreyChem provides custom synthesis services for F0579-0781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.