F0579-0835
TL;DR: F0579-0835 (CAS 687568-59-8) is a chemical compound with molecular formula C19H20N4O5S2 and molecular weight 448.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(4-nitrophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(oxolan-2-ylmethyl)acetamide
Also Known As: F0579-0835, 2-{[3-(4-nitrophenyl)-4-oxo-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]acetamide, 2-((3-(4-nitrophenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)-N-((tetrahydrofuran-2-yl)methyl)acetamide, 2-[[3-(4-nitrophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(oxolan-2-ylmethyl)acetamide
| Molecular Formula | C19H20N4O5S2 |
|---|---|
| Molecular Weight | 448.09 g/mol |
| LogP | 2.1762 |
| Topological Polar Surface Area | 116.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 448.08752 |
| Heavy Atoms | 30 |
| Complexity | 1018.8202 |
Chemical Identifiers
| CAS Number | 687568-59-8 |
|---|---|
| SMILES | C1CC(OC1)CNC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)[N+](=O)[O-])SCC3 |
Product Overview
F0579-0835 (CAS 687568-59-8), with molecular formula C19H20N4O5S2 and molecular weight 448.09 g/mol. IUPAC: 2-[[3-(4-nitrophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(oxolan-2-ylmethyl)acetamide.
Chemical Property Profile of F0579-0835
Property Insights of F0579-0835
The XLogP value of 2.1762 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0579-0835. The TPSA of 116.36 Ų falls within the moderate polarity range, balancing permeability and solubility for F0579-0835. Following Lipinski's Rule of Five, F0579-0835 has 1 hydrogen bond donor(s) and 8 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 F0579-0835?
The CAS number of F0579-0835 is 687568-59-8.
What is the molecular formula of F0579-0835?
The molecular formula of F0579-0835 is C19H20N4O5S2.
What is the molecular weight of F0579-0835?
The molecular weight of F0579-0835 is 448.09 g/mol.
Where can I buy F0579-0835?
You can request a quote for F0579-0835 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0579-0835?
Yes, KEHONG BIO provides custom synthesis services for F0579-0835 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.