![3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin structure](/static/products/5561/556-12-7.webp)
3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin
TL;DR: 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin (CAS 556-12-7) is a chemical compound with molecular formula C9H7N5O3 and molecular weight 233.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(5-nitrofuran-2-yl)ethenyl]-1,2,4-triazin-3-amine
Also Known As: Furalazine, 3-Amino-6-(2-(5-nitro-2-furyl)vinyl)-1,2,4-triazine, 3-amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin, 6-[2-(5-Nitrofuran-2-yl)ethen-1-yl]-1,2,4-triazin-3-amine
| Molecular Formula | C9H7N5O3 |
|---|---|
| Molecular Weight | 233.05 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.05489 |
| Heavy Atoms | 17 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 556-12-7 |
|---|---|
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])C=CC2=CN=C(N=N2)N |
| InChIKey | RWOLIGKRDWLZSV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin (CAS 556-12-7), with molecular formula C9H7N5O3 and molecular weight 233.05 g/mol. IUPAC: 6-[2-(5-nitrofuran-2-yl)ethenyl]-1,2,4-triazin-3-amine.
Chemical Property Profile of 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin
Property Insights of 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin. Following Lipinski's Rule of Five, 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin has 1 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 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin?
The CAS number of 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin is 556-12-7.
What is the molecular formula of 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin?
The molecular formula of 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin is C9H7N5O3.
What is the molecular weight of 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin?
The molecular weight of 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin is 233.05 g/mol.
Where can I buy 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin?
You can request a quote for 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-6-[2-(5-nitro-2-furyl)-vinyl]-1,2,4-triazin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.