1-Benzenesulfonyl-piperazine

C₁₀H₁₄N₂O₂SCAS 14172-55-5226.29 g/mol

Open in Covalent MOL file

Secondary amine Sulfonamide

Properties

Molecular formula: C₁₀H₁₄N₂O₂S
Molar mass: 226.29 g/mol
Exact mass: 226.0776 Da
logP: 0.28Crippen estimate
Polar surface area: 49.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

Identifiers

CAS number

14172-55-5

SMILES

C1CN(CCN1)S(=O)(=O)C2=CC=CC=C2

InChIKey

NANQJUFFKXWVJR-UHFFFAOYSA-N

InChI

InChI=1S/C10H14N2O2S/c13-15(14,10-4-2-1-3-5-10)12-8-6-11-7-9-12/h1-5,11H,6-9H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

1-(Benzenesulfonyl)piperazine

Work with 1-Benzenesulfonyl-piperazine

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-Methylphenyl)sulfonyl]piperazine27106-51-067 % similar N-Fluorobenzenesulfonimide133745-75-247 % similar Phenylpiperazine92-54-644 % similar 1-Benzylpiperazine2759-28-641 % similar 1-(2-Phenylethyl)piperazine5321-49-341 % similar 4-(Morpholinosulfonyl)aniline21626-70-041 % similar N,N-Bis(2-chloroethyl)-4-methylbenzenesulfonamide42137-88-241 % similar 1-Phenylpiperazine hydrochloride2210-93-740 % similar

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

Same formula

4-(4-Aminophenyl)thiomorpholine 1,1-dioxide105297-10-7

Elsewhere

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