N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide
TL;DR: N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide (CAS 33980-43-7) is a chemical compound with molecular formula C11H12N4O and molecular weight 216.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-2-phenyl-N-(1,2,4-triazol-4-yl)acetamide
Also Known As: 4-(N-methyl-N-phenylacetylamino)-4H-1,2,4-triazole, AJ-333/15478017, N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide, N-methyl-2-phenyl-N-(1,2,4-triazol-4-yl)acetamide
| Molecular Formula | C11H12N4O |
|---|---|
| Molecular Weight | 216.10 g/mol |
| LogP | 0.6152 |
| Topological Polar Surface Area | 51.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.1011 |
| Heavy Atoms | 16 |
| Complexity | 452.1015 |
Chemical Identifiers
| CAS Number | 33980-43-7 |
|---|---|
| SMILES | CN(C(=O)CC1=CC=CC=C1)N2C=NN=C2 |
Product Overview
N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide (CAS 33980-43-7), with molecular formula C11H12N4O and molecular weight 216.10 g/mol. IUPAC: N-methyl-2-phenyl-N-(1,2,4-triazol-4-yl)acetamide.
Chemical Property Profile of N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide
Property Insights of N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide
The XLogP value of 0.6152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide. With a topological polar surface area (TPSA) of 51.02 Ų, N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide 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 N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide?
The CAS number of N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide is 33980-43-7.
What is the molecular formula of N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide?
The molecular formula of N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide is C11H12N4O.
What is the molecular weight of N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide?
The molecular weight of N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide is 216.10 g/mol.
Where can I buy N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide?
You can request a quote for N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-2-phenyl-N-(4H-1,2,4-triazol-4-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.