N-(1-(3-Chlorophenyl)ethyl)-2-nitro-5-(piperazin-1-yl)benzenamine hydrochloride

HCID 67147352
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Basic information

Standard SMILES
CC(Nc1cc(N2CCNCC2)ccc1[N+](=O)[O-])c1cccc(Cl)c1.Cl
InChIKey
QCOOSUHMANTJJW-UHFFFAOYSA-N
Molecular formula
C18H22Cl2N4O2
Average molar mass
397.3 g/mol

Names & identifiers

Preferred name
N-(1-(3-Chlorophenyl)ethyl)-2-nitro-5-(piperazin-1-yl)benzenamine hydrochloride
IUPAC
N-[1-(3-chlorophenyl)ethyl]-2-nitro-5-piperazin-1-ylaniline;hydrochloride

Names & synonyms

SCHEMBL1748344QCOOSUHMANTJJW-UHFFFAOYSA-NN-(1 -(3-Chlorophenyl)ethyl)-2-nitro-5-(piperazin-1-yl)benzenamine hydrochlorideN-(1-(3-Chlorophenyl)ethyl)-2-nitro-5-(piperazin-1-yl)benzenamine hydrochloride

Database identifiers

PubChem CID
67147352

Properties

Computed structural properties

Topological polar surface area
73.1 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
26

Related reactions

2 records
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Compound notes

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