2-((4-Amino-5-(4-pyridinyl)4H-1,2,4-triazol-3-YL)thio)-N-(2,6-DI-ME-PH)acetamide
2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-dimethylphenyl)acetamide
Also Known As: 2-((4-amino-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,6-dimethylphenyl)acetamide|2-{[4-amino-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide|F2649-0080|2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-dimethylphenyl)acetamide|2-((4-Amino-5-(4-pyridinyl)4H-1,2,4-triazol-3-YL)thio)-N-(2,6-DI-ME-PH)acetamide|2-(4-amino-5-(4-pyridyl)(1,2,4-triazol-3-ylthio))-N-(2,6-dimethylphenyl)acetam ide|2-{[4-amino-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide|655-738-1
| Molecular Formula | C17H18N6OS |
|---|---|
| Molecular Weight | 354.12628 g/mol |
| LogP | 2.40154 |
| Topological Polar Surface Area | 98.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.12628 |
| Monoisotopic Mass | 354.12628 |
| Heavy Atoms | 25 |
| Complexity | 873.1586 |
Chemical Identifiers
| CAS Number | 577997-00-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)CSC2=NN=C(N2N)C3=CC=NC=C3 |
Product Overview
2-((4-Amino-5-(4-pyridinyl)4H-1,2,4-triazol-3-YL)thio)-N-(2,6-DI-ME-PH)acetamide (CAS 577997-00-3), with molecular formula C17H18N6OS and molecular weight 354.12628 g/mol. IUPAC: 2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-dimethylphenyl)acetamide.