5-Amino-2-chloro-N-(2,4-dimethylphenyl)benzenesulfonamide

C₁₄H₁₅ClN₂O₂SCAS 71215-81-1310.80 g/mol

Open in Covalent MOL file

Aryl halide Primary amine Sulfonamide

Properties

Molecular formula: C₁₄H₁₅ClN₂O₂S
Molar mass: 310.80 g/mol
Exact mass: 310.0543 Da
logP: 3.34Crippen estimate
Polar surface area: 72.2 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 3

Identifiers

CAS number

71215-81-1

SMILES

Cc1ccc(NS(=O)(=O)c2cc(N)ccc2Cl)c(C)c1

InChIKey

SOWYLSRVTBKKJE-UHFFFAOYSA-N

InChI

InChI=1S/C14H15ClN2O2S/c1-9-3-6-13(10(2)7-9)17-20(18,19)14-8-11(16)4-5-12(14)15/h3-8,17H,16H2,1-2H3

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Names and synonyms

1 names

Benzenesulfonamide, 5-amino-2-chloro-N-(2,4-dimethylphenyl)-

Work with 5-Amino-2-chloro-N-(2,4-dimethylphenyl)benzenesulfonamide

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

5-Amino-2-methyl-N-phenylbenzenesulfonamide79-72-147 % similar 5-Amino-2-chlorobenzenesulfonic acid88-43-744 % similar 4-Chloro-3-methylaniline7149-75-943 % similar 3-Chloro-4-methylaniline95-74-940 % similar 5-Amino-2-methylbenzenesulfonamide6973-09-739 % similar 5-Amino-2-methylbenzenesulfonic acid118-88-738 % similar 2-Chloro-5-methylaniline95-81-837 % similar 2,4-Dimethylbenzenesulfonyl chloride609-60-937 % similar

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

Elsewhere

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