N-{4-[4-(4-Nitropyrid-2-yl)piperazin-1-yl]phenyl}methanesulphonamide

HCID 21283530
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Basic information

Standard SMILES
CS(=O)(=O)Nc1ccc(N2CCN(c3cc([N+](=O)[O-])ccn3)CC2)cc1
InChIKey
JTVLDOZYZPSYDW-UHFFFAOYSA-N
Molecular formula
C16H19N5O4S
Average molar mass
377.4 g/mol

Names & identifiers

Preferred name
N-{4-[4-(4-Nitropyrid-2-yl)piperazin-1-yl]phenyl}methanesulphonamide
IUPAC
N-[4-[4-(4-nitro-2-pyridinyl)piperazin-1-yl]phenyl]methanesulfonamide

Names & synonyms

SCHEMBL10680167JTVLDOZYZPSYDW-UHFFFAOYSA-NN-{4-[4-(4-Nitropyrid-2-yl)piperazin-1-yl]phenyl}methanesulphonamide

Database identifiers

PubChem CID
21283530

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
120 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
4
Heavy atoms
26

Related reactions

4 records
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Compound notes

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