(E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine
TL;DR: (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine (CAS 35554-52-0) is a chemical compound with molecular formula C12H12N4 and molecular weight 212.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E,Z)-2-methyl-3-phenyl-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine
Also Known As: Quebrachamine, (Z)-2-methyl-3-phenyl-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine, (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine, [(Z)-2-Methyl-3-phenyl-prop-2-en-(E)-ylidene]-[1,2,4]triazol-4-yl-amine
| Molecular Formula | C12H12N4 |
|---|---|
| Molecular Weight | 212.11 g/mol |
| LogP | 2.2155 |
| Topological Polar Surface Area | 43.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.1062 |
| Heavy Atoms | 16 |
| Complexity | 483.002 |
Chemical Identifiers
| CAS Number | 35554-52-0 |
|---|---|
| SMILES | C/C(=C/C1=CC=CC=C1)/C=N/N2C=NN=C2 |
Product Overview
(E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine (CAS 35554-52-0), with molecular formula C12H12N4 and molecular weight 212.11 g/mol. IUPAC: (E,Z)-2-methyl-3-phenyl-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine.
Chemical Property Profile of (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine
Property Insights of (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine
The XLogP value of 2.2155 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine. With a topological polar surface area (TPSA) of 43.07 Ų, (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine has 0 hydrogen bond donor(s) and 3 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 (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine?
The CAS number of (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine is 35554-52-0.
What is the molecular formula of (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine?
The molecular formula of (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine is C12H12N4.
What is the molecular weight of (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine?
The molecular weight of (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine is 212.11 g/mol.
Where can I buy (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine?
You can request a quote for (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-((Z)-2-methyl-3-phenylallylidene)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.