N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine
TL;DR: N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine (CAS 117979-25-6) is a chemical compound with molecular formula C10H10N4 and molecular weight 186.09055 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-phenyl-N-(1,2,4-triazol-4-yl)ethanimine
Also Known As: 1-phenyl-N-(1,2,4-triazol-4-yl)ethanimine, N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine, (E)-1-phenyl-N-(1,2,4-triazol-4-yl)ethanimine, AE-848/32733044
Technical Specifications
| Molecular Formula | C10H10N4 |
| Molecular Weight | 186.09055 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.09055 Da |
| Heavy Atoms | 14 |
| Complexity | 202.0 |
| SMILES | C/C(=N\N1C=NN=C1)/C2=CC=CC=C2 |
| InChIKey | HWPMKZSAYRLELT-UKTHLTGXSA-N |
Chemical Property Profile of N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine
Property Insights of N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine. With a topological polar surface area (TPSA) of 43.1 Ų, N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)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
What is the CAS number of N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine?
The CAS number of N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine is 117979-25-6.
What is the molecular formula of N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine?
The molecular formula of N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine is C10H10N4.
What is the molecular weight of N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine?
The molecular weight of N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine is 186.09055 g/mol.
Where can I buy N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine?
You can request a quote for N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine?
Yes, CoreyChem provides custom synthesis services for N-(1-phenylethylidene)-N-(4H-1,2,4-triazol-4-yl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.