F0579-0841
TL;DR: F0579-0841 (CAS 1023817-94-8) is a chemical compound with molecular formula C24H22N4O6S3 and molecular weight 558.0701 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[[2-[[3-(4-nitrophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: F0579-0841, ethyl 2-(2-((3-(4-nitrophenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-[[2-[[3-(4-nitrophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, Ethyl 5,6-dihydro-2-[[2-[[3,4,6,7-tetrahydro-3-(4-nitrophenyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]thio]acetyl]amino]-4H-cyclopenta[b]thiophene-3-carboxylate
Technical Specifications
| Molecular Formula | C24H22N4O6S3 |
| Molecular Weight | 558.0701 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 213.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 558.0701 Da |
| Heavy Atoms | 37 |
| Complexity | 1020.0 |
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CSC3=NC4=C(C(=O)N3C5=CC=C(C=C5)[N+](=O)[O-])SCC4 |
| InChIKey | YKTBDJCOILJIBW-UHFFFAOYSA-N |
Chemical Property Profile of F0579-0841
Property Insights of F0579-0841
The XLogP value of 4.9 indicates that F0579-0841 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 213.0 Ų indicates high polarity, suggesting F0579-0841 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0579-0841 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of F0579-0841?
The CAS number of F0579-0841 is 1023817-94-8.
What is the molecular formula of F0579-0841?
The molecular formula of F0579-0841 is C24H22N4O6S3.
What is the molecular weight of F0579-0841?
The molecular weight of F0579-0841 is 558.0701 g/mol.
Where can I buy F0579-0841?
You can request a quote for F0579-0841 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F0579-0841?
Yes, CoreyChem provides custom synthesis services for F0579-0841 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.