1-[[2,4,6-Tris(1-methylethyl)phenyl]sulfonyl]-1H-imidazole

C₁₈H₂₆N₂O₂SCAS 50257-40-4334.48 g/mol

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Properties

Molecular formula: C₁₈H₂₆N₂O₂S
Molar mass: 334.48 g/mol
Exact mass: 334.1715 Da
Melting point: 118–119 °C
logP: 4.49Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 5

Identifiers

CAS number

50257-40-4

SMILES

CC(C)c1cc(C(C)C)c(S(=O)(=O)n2ccnc2)c(C(C)C)c1

InChIKey

AGGRGODMKWLSDE-UHFFFAOYSA-N

InChI

InChI=1S/C18H26N2O2S/c1-12(2)15-9-16(13(3)4)18(17(10-15)14(5)6)23(21,22)20-8-7-19-11-20/h7-14H,1-6H3

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Names and synonyms

6 names

1H-Imidazole, 1-[[2,4,6-tris(1-methylethyl)phenyl]sulfonyl]-
1-(2,4,6-Triisoprolylphenylsulfonyl)-1H-imidazole
1-(2,4,6-Triisopropylphenylsulfonyl)-1H-imidazole
1-(2,4,6-Triisopropylphenylsulfonyl)imidazole
1-(2,4,6-Triisopropyl-benzenesulfonyl)-1H-imidazole
1-[2,4,6-Tri(propan-2-yl)phenyl]sulfonylimidazole

Work with 1-[[2,4,6-Tris(1-methylethyl)phenyl]sulfonyl]-1H-imidazole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Elsewhere

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