N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine
TL;DR: N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine (CAS 89975-90-6) is a chemical compound with molecular formula C7H6N4O and molecular weight 162.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(furan-2-yl)-N-(1H-1,2,4-triazol-5-yl)methanimine
Also Known As: N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine, 1-(furan-2-yl)-N-(1H-1,2,4-triazol-5-yl)methanimine, (E)-1-(furan-2-yl)-N-(1H-1,2,4-triazol-5-yl)methanimine
| Molecular Formula | C7H6N4O |
|---|---|
| Molecular Weight | 162.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 67.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.05415 |
| Heavy Atoms | 12 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 89975-90-6 |
|---|---|
| SMILES | C1=COC(=C1)C=NC2=NC=NN2 |
| InChIKey | VNRKMYIZSYYQSF-UHFFFAOYSA-N |
Product Overview
N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine (CAS 89975-90-6), with molecular formula C7H6N4O and molecular weight 162.05 g/mol. IUPAC: 1-(furan-2-yl)-N-(1H-1,2,4-triazol-5-yl)methanimine.
Chemical Property Profile of N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine
Property Insights of N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine. The TPSA of 67.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine. Following Lipinski's Rule of Five, N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine has 1 hydrogen bond donor(s) and 4 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 N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine?
The CAS number of N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine is 89975-90-6.
What is the molecular formula of N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine?
The molecular formula of N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine is C7H6N4O.
What is the molecular weight of N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine?
The molecular weight of N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine is 162.05 g/mol.
Where can I buy N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine?
You can request a quote for N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(furan-2-yl-methylene)-1h-1,2,4-triazole-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.