Nitrovin
TL;DR: Nitrovin (CAS 804-36-4) is a chemical compound with molecular formula C14H12N6O6 and molecular weight 360.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1,5-bis(5-nitrofuran-2-yl)penta-1,4-dien-3-ylideneamino]guanidine
Also Known As: NITROVIN, Difurazone, Payzone, Biovin 4, Nitrovin [BAN]
| Molecular Formula | C14H12N6O6 |
|---|---|
| Molecular Weight | 360.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 195.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.08182 |
| Heavy Atoms | 26 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 804-36-4 |
|---|---|
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])C=CC(=NN=C(N)N)C=CC2=CC=C(O2)[N+](=O)[O-] |
| InChIKey | XQCFHQBGMWUEMY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nitrovin (CAS 804-36-4), with molecular formula C14H12N6O6 and molecular weight 360.08 g/mol. IUPAC: 2-[1,5-bis(5-nitrofuran-2-yl)penta-1,4-dien-3-ylideneamino]guanidine.
Chemical Property Profile of Nitrovin
Property Insights of Nitrovin
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nitrovin. The TPSA of 195.0 Ų indicates high polarity, suggesting Nitrovin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nitrovin 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 Nitrovin?
The CAS number of Nitrovin is 804-36-4.
What is the molecular formula of Nitrovin?
The molecular formula of Nitrovin is C14H12N6O6.
What is the molecular weight of Nitrovin?
The molecular weight of Nitrovin is 360.08 g/mol.
Where can I buy Nitrovin?
You can request a quote for Nitrovin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitrovin?
Yes, KEHONG BIO provides custom synthesis services for Nitrovin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.