Nifursol
TL;DR: Nifursol (CAS 1246833-64-6) is a chemical compound with molecular formula C12H7N5O9 and molecular weight 365.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-3,5-dinitro-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzamide
Also Known As: NIFURSOL, Histomon, Salfuride, Sulfuride, Nifursolum
| Molecular Formula | C12H7N5O9 |
|---|---|
| Molecular Weight | 365.02 g/mol |
| LogP | 1.4737 |
| Topological Polar Surface Area | 204.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 365.02438 |
| Heavy Atoms | 26 |
| Complexity | 948.56305 |
Chemical Identifiers
| CAS Number | 1246833-64-6 |
|---|---|
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])/C=N/NC(=O)C2=C(C(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])O |
Product Overview
Nifursol (CAS 1246833-64-6), with molecular formula C12H7N5O9 and molecular weight 365.02 g/mol. IUPAC: 2-hydroxy-3,5-dinitro-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzamide.
Chemical Property Profile of Nifursol
Property Insights of Nifursol
The XLogP value of 1.4737 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nifursol. The TPSA of 204.25 Ų indicates high polarity, suggesting Nifursol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nifursol 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
Frequently Asked Questions
What is the CAS number of Nifursol?
The CAS number of Nifursol is 1246833-64-6.
What is the molecular formula of Nifursol?
The molecular formula of Nifursol is C12H7N5O9.
What is the molecular weight of Nifursol?
The molecular weight of Nifursol is 365.02 g/mol.
Where can I buy Nifursol?
You can request a quote for Nifursol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nifursol?
Yes, KEHONG BIO provides custom synthesis services for Nifursol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.