RefChem:236971
1-[[(2R,4S)-2-(1-benzofuran-2-yl)-4-(phenoxymethyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole
Also Known As: 1H-1,2,4-Triazole, 1-((2-(2-benzofuranyl)-4-(phenoxymethyl)-1,3-dioxolan-2-yl)methyl)-, trans-|trans-1-((2-(2-Benzofuranyl)-4-(phenoxymethyl)-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole|trans-2-(Benzofuran-2-yl)-2-(1-(1H-1,2,4-triazolyl)-methyl)-4-phenoxymethyl-1,3-dioxolan|1-[[(2R,4S)-2-(1-benzofuran-2-yl)-4-(phenoxymethyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole|1-{[(2R,4S)-2-(1-Benzofuran-2-yl)-4-(phenoxymethyl)-1,3-dioxolan-2-yl]methyl}-1H-1,2,4-triazole|1H-1,2,4-Triazole, 1-((2-(2-benzofuranyl)-4-(phenoxymethyl)-1,3-dioxolan-2-yl)methyl)-, cis-
| Molecular Formula | C21H19N3O4 |
|---|---|
| Molecular Weight | 377.13754 g/mol |
| LogP | 3.3717 |
| Topological Polar Surface Area | 71.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 377.13754 |
| Monoisotopic Mass | 377.13754 |
| Heavy Atoms | 28 |
| Complexity | 1014.9158 |
Chemical Identifiers
| CAS Number | 98519-30-3 |
|---|---|
| SMILES | C1[C@@H](O[C@](O1)(CN2C=NC=N2)C3=CC4=CC=CC=C4O3)COC5=CC=CC=C5 |
Product Overview
RefChem:236971 (CAS 98519-30-3), with molecular formula C21H19N3O4 and molecular weight 377.13754 g/mol. IUPAC: 1-[[(2R,4S)-2-(1-benzofuran-2-yl)-4-(phenoxymethyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole.
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