AC1MI428

1-[[2-(1-benzofuran-2-yl)-5-butyl-5-ethyl-1,3-dioxan-2-yl]methyl]-1,2,4-triazole

Also Known As: trans-1-((2-(2-Benzofuranyl)-5-butyl-5-ethyl-1,3-dioxan-2-yl)methyl)-1H-1,2,4-triazole|1H-1,2,4-Triazole, 1-((2-(2-benzofuranyl)-5-butyl-5-ethyl-1,3-dioxan-2-yl)methyl)-, cis-|1H-1,2,4-Triazole, 1-((2-(2-benzofuranyl)-5-butyl-5-ethyl-1,3-dioxan-2-yl)methyl)-, trans-|cis-1-((2-(2-Benzofuranyl)-5-butyl-5-ethyl-1,3-dioxan-2-yl)methyl)-1H-1,2,4-triazole|cis-2-(Benzofuran-2-yl)-2-(1H-1,2,4-triazolyl)-methyl-5-ethyl-5-butyl-1,3-dioxan [German]|trans-2-(Benzofuran-2-yl)-2-((1H-1,2,4-triazolyl)-methyl)-5-ethyl-5-butyl-1,3-dioxan|cis-2-(Benzofuran-2-yl)-2-(1H-1,2,4-triazolyl)-methyl-5-ethyl-5-butyl-1,3-dioxan|1-[[2-(1-benzofuran-2-yl)-5-butyl-5-ethyl-1,3-dioxan-2-yl]methyl]-1,2,4-triazole|1-{[(2s,5s)-2-(1-Benzofuran-2-yl)-5-butyl-5-ethyl-1,3-dioxan-2-yl]methyl}-1H-1,2,4-triazole|1-{[cis-2-(1-benzofuran-2-yl)-5-butyl-5-ethyl-1,3-dioxan-2-yl]methyl}-1H-1,2,4-triazole|1-{[trans-2-(1-benzofuran-2-yl)-5-butyl-5-ethyl-1,3-dioxan-2-yl]methyl}-1H-1,2,4-triazole

Molecular Formula	C21H27N3O3
Molecular Weight	369.20523 g/mol
LogP	4.5107
Topological Polar Surface Area	62.31 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	7
Exact Mass	369.20523
Monoisotopic Mass	369.20523
Heavy Atoms	27
Complexity	830.8242

Chemical Identifiers

CAS Number	98532-84-4
SMILES	CCCCC1(COC(OC1)(CN2C=NC=N2)C3=CC4=CC=CC=C4O3)CC