F3217-0041
TL;DR: F3217-0041 (CAS 634581-62-7) is a chemical compound with molecular formula C18H12N2O8S2 and molecular weight 448.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5Z)-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid
Also Known As: F3217-0041, 2-[(5Z)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid, (Z)-2-(5-((5-(2-nitrophenyl)furan-2-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)succinic acid, 2-[(5Z)-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid
| Molecular Formula | C18H12N2O8S2 |
|---|---|
| Molecular Weight | 448.00 g/mol |
| LogP | 2.9839 |
| Topological Polar Surface Area | 151.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 448.0035 |
| Heavy Atoms | 30 |
| Complexity | 1107.111 |
Chemical Identifiers
| CAS Number | 634581-62-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=CC=C(O2)/C=C\3/C(=O)N(C(=S)S3)C(CC(=O)O)C(=O)O)[N+](=O)[O-] |
Product Overview
F3217-0041 (CAS 634581-62-7), with molecular formula C18H12N2O8S2 and molecular weight 448.00 g/mol. IUPAC: 2-[(5Z)-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid.
Chemical Property Profile of F3217-0041
Property Insights of F3217-0041
The XLogP value of 2.9839 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F3217-0041. The TPSA of 151.19 Ų indicates high polarity, suggesting F3217-0041 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F3217-0041 has 2 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 F3217-0041?
The CAS number of F3217-0041 is 634581-62-7.
What is the molecular formula of F3217-0041?
The molecular formula of F3217-0041 is C18H12N2O8S2.
What is the molecular weight of F3217-0041?
The molecular weight of F3217-0041 is 448.00 g/mol.
Where can I buy F3217-0041?
You can request a quote for F3217-0041 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3217-0041?
Yes, KEHONG BIO provides custom synthesis services for F3217-0041 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.