F1063-0697
TL;DR: F1063-0697 (CAS 681817-46-9) is a chemical compound with molecular formula C18H19NO5S2 and molecular weight 393.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate
Also Known As: F1063-0697, (Z)-propyl 4-(5-(benzo[d][1,3]dioxol-5-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoate, propyl 4-[(5Z)-5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate, propyl 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate, propyl 4-[5-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethylene)-4-oxo-2-thioxo-1,3-thi azolidin-3-yl]butanoate
| Molecular Formula | C18H19NO5S2 |
|---|---|
| Molecular Weight | 393.07 g/mol |
| LogP | 3.3499 |
| Topological Polar Surface Area | 65.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 393.07047 |
| Heavy Atoms | 26 |
| Complexity | 761.94836 |
Chemical Identifiers
| CAS Number | 681817-46-9 |
|---|---|
| SMILES | CCCOC(=O)CCCN1C(=O)/C(=C/C2=CC3=C(C=C2)OCO3)/SC1=S |
Product Overview
F1063-0697 (CAS 681817-46-9), with molecular formula C18H19NO5S2 and molecular weight 393.07 g/mol. IUPAC: propyl 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate.
Chemical Property Profile of F1063-0697
Property Insights of F1063-0697
The XLogP value of 3.3499 indicates that F1063-0697 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.07 Ų falls within the moderate polarity range, balancing permeability and solubility for F1063-0697. Following Lipinski's Rule of Five, F1063-0697 has 0 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 F1063-0697?
The CAS number of F1063-0697 is 681817-46-9.
What is the molecular formula of F1063-0697?
The molecular formula of F1063-0697 is C18H19NO5S2.
What is the molecular weight of F1063-0697?
The molecular weight of F1063-0697 is 393.07 g/mol.
Where can I buy F1063-0697?
You can request a quote for F1063-0697 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1063-0697?
Yes, KEHONG BIO provides custom synthesis services for F1063-0697 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.