2-[2-(1-Piperazinyl)-5-thiadiazolyl]-1-methyl-5-nitroimidazole

HCID 21390830

Basic information

Standard SMILES
Cn1c([N+](=O)[O-])cnc1C1=CNN(N2CCNCC2)S1
InChIKey
DOPOFAWNSZQNHJ-UHFFFAOYSA-N
Molecular formula
C10H15N7O2S
Average molar mass
297.34 g/mol
Monoisotopic mass
297.10079392

Names & identifiers

Preferred name
2-[2-(1-Piperazinyl)-5-thiadiazolyl]-1-methyl-5-nitroimidazole
IUPAC
5-(1-methyl-5-nitroimidazol-2-yl)-2-piperazin-1-yl-3H-thiadiazole

Names & synonyms

SCHEMBL11731425DOPOFAWNSZQNHJ-UHFFFAOYSA-N2-[2-(1-Piperazinyl)-5-thiadiazolyl]-1-methyl-5nitroimidazole2-[2-(1-Piperazinyl)-5-thiadiazolyl]-1-methyl-5-nitroimidazole

Database identifiers

PubChem CID
21390830

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
119 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
2
Heavy atoms
20

Related reactions

3 records

Linked notes

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