tert-Butylphenyl imidazolylphenyl sulfonamide

C₁₉H₂₁N₃O₂SCAS 945526-43-2355.46 g/mol

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Properties

Molecular formula: C₁₉H₂₁N₃O₂S
Molar mass: 355.46 g/mol
Exact mass: 355.1354 Da
logP: 3.97Crippen estimate
Polar surface area: 64.0 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

945526-43-2

SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3C=CN=C3

InChIKey

XQABBHBFHWHMKF-UHFFFAOYSA-N

InChI

InChI=1S/C19H21N3O2S/c1-19(2,3)15-4-10-18(11-5-15)25(23,24)21-16-6-8-17(9-7-16)22-13-12-20-14-22/h4-14,21H,1-3H3

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Names and synonyms

1 names

[4-T-Butylphenyl]-N-(4-imidazol-1-yl phenyl)sulfonamide, benzenesulfonamide, 4-(1,1-dimethylethyl)-N-[4-(1H-imidazol-1-yl)phenyl]-

Work with tert-Butylphenyl imidazolylphenyl sulfonamide

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

Similar compounds

1-(4-Trifluoromethylphenyl)imidazole25371-98-644 % similar 4-(1H-Imidazol-1-yl)aniline2221-00-340 % similar 4-tert-Butylbenzenesulfonamide6292-59-740 % similar 4,4'-Di(1H-imidazol-1-yl)-1,1'-biphenyl855766-92-640 % similar 1-[4-(1H-Imidazol-1-yl)phenyl]ethanone10041-06-238 % similar Tris[4-(1H-imidazol-1-yl)-phenyl]amine1258947-79-338 % similar 4,4′-Diaminobenzenesulfonanilide16803-97-738 % similar 1-(4-Methoxyphenyl)-1H-imidazole10040-95-638 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Amino-5-((4-(2-(5-ethyl-2-pyridinyl)ethoxy)phenyl)methyl)-4(5H)-thiazolone105355-26-8

Elsewhere

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