rhodanine derivative, 6
TL;DR: rhodanine derivative, 6 (CAS 1204732-04-6) is a chemical compound with molecular formula C19H14N2O8S2 and molecular weight 462.01917 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(5Z)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioic acid
Also Known As: rhodanine derivative, 6, AB00684091-01, (Z)-2-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)pentanedioic acid, 2-(5-{[5-(4-nitrophenyl)(2-furyl)]methylene}-4-oxo-2-thioxo-1,3-thiazolidin-3- yl)pentanedioic acid, 2-[(5Z)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioic acid
Technical Specifications
| Molecular Formula | C19H14N2O8S2 |
| Molecular Weight | 462.01917 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 211.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 462.01917 Da |
| Heavy Atoms | 31 |
| Complexity | 803.0 |
| SMILES | C1=CC(=CC=C1C2=CC=C(O2)/C=C\3/C(=O)N(C(=S)S3)C(CCC(=O)O)C(=O)O)[N+](=O)[O-] |
| InChIKey | AAYFBVCMIGADEC-DHDCSXOGSA-N |
Chemical Property Profile of rhodanine derivative, 6
Property Insights of rhodanine derivative, 6
The XLogP value of 3.1 indicates that rhodanine derivative, 6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 211.0 Ų indicates high polarity, suggesting rhodanine derivative, 6 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, rhodanine derivative, 6 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of rhodanine derivative, 6?
The CAS number of rhodanine derivative, 6 is 1204732-04-6.
What is the molecular formula of rhodanine derivative, 6?
The molecular formula of rhodanine derivative, 6 is C19H14N2O8S2.
What is the molecular weight of rhodanine derivative, 6?
The molecular weight of rhodanine derivative, 6 is 462.01917 g/mol.
Where can I buy rhodanine derivative, 6?
You can request a quote for rhodanine derivative, 6 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for rhodanine derivative, 6?
Yes, CoreyChem provides custom synthesis services for rhodanine derivative, 6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.