2-[2-(3-Dimethylaminopropylamino)-5-thiadiazolyl]-1-methyl-5-nitroimidazole

HCID 21390856
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Basic information

Standard SMILES
CN(C)CCCNN1NC=C(c2ncc([N+](=O)[O-])n2C)S1
InChIKey
BARAZOAYQYUYMQ-UHFFFAOYSA-N
Molecular formula
C11H19N7O2S
Average molar mass
313.38 g/mol

Names & identifiers

Preferred name
2-[2-(3-Dimethylaminopropylamino)-5-thiadiazolyl]-1-methyl-5-nitroimidazole
IUPAC
N',N'-dimethyl-N-[5-(1-methyl-5-nitroimidazol-2-yl)-3H-thiadiazol-2-yl]propane-1,3-diamine

Names & synonyms

SCHEMBL11726588BARAZOAYQYUYMQ-UHFFFAOYSA-N2-[2-(3-Dimethylaminopropylamino)-5-thiadiazolyl]-1-methyl-5-nitroimidazole

Database identifiers

PubChem CID
21390856

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
119 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
21

Related reactions

3 records
New reaction record

Linked notes

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