F1063-2048
TL;DR: F1063-2048 (CAS 682764-14-3) is a chemical compound with molecular formula C17H22N4O3S2 and molecular weight 394.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-methylpiperazin-1-yl)butanamide
Also Known As: F1063-2048, (E)-4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(4-methylpiperazin-1-yl)butanamide, 4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-methylpiperazin-1-yl)butanamide, 4-[(5E)-5-[(furan-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-methylpiperazin-1-yl)butanamide, 4-[5-(2-furylmethylene)-4-oxo-2-thioxo(1,3-thiazolidin-3-yl)]-N-(4-methylpiper azinyl)butanamide
| Molecular Formula | C17H22N4O3S2 |
|---|---|
| Molecular Weight | 394.11 g/mol |
| LogP | 1.5396 |
| Topological Polar Surface Area | 69.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.11334 |
| Heavy Atoms | 26 |
| Complexity | 696.871 |
Chemical Identifiers
| CAS Number | 682764-14-3 |
|---|---|
| SMILES | CN1CCN(CC1)NC(=O)CCCN2C(=O)/C(=C\C3=CC=CO3)/SC2=S |
Product Overview
F1063-2048 (CAS 682764-14-3), with molecular formula C17H22N4O3S2 and molecular weight 394.11 g/mol. IUPAC: 4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-methylpiperazin-1-yl)butanamide.
Chemical Property Profile of F1063-2048
Property Insights of F1063-2048
The XLogP value of 1.5396 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1063-2048. The TPSA of 69.03 Ų falls within the moderate polarity range, balancing permeability and solubility for F1063-2048. Following Lipinski's Rule of Five, F1063-2048 has 1 hydrogen bond donor(s) and 7 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 F1063-2048?
The CAS number of F1063-2048 is 682764-14-3.
What is the molecular formula of F1063-2048?
The molecular formula of F1063-2048 is C17H22N4O3S2.
What is the molecular weight of F1063-2048?
The molecular weight of F1063-2048 is 394.11 g/mol.
Where can I buy F1063-2048?
You can request a quote for F1063-2048 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1063-2048?
Yes, KEHONG BIO provides custom synthesis services for F1063-2048 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.