2-(2-Hydroxymethylamino-5-thiadiazolyl)-1-methyl-5-nitroimidazole

HCID 21390852
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Basic information

Standard SMILES
Cn1c([N+](=O)[O-])cnc1C1=CNN(NCO)S1
InChIKey
HMSQCAPBQMYPMV-UHFFFAOYSA-N
Molecular formula
C7H10N6O3S
Average molar mass
258.26 g/mol

Names & identifiers

Preferred name
2-(2-Hydroxymethylamino-5-thiadiazolyl)-1-methyl-5-nitroimidazole
IUPAC
[[5-(1-methyl-5-nitroimidazol-2-yl)-3H-thiadiazol-2-yl]amino]methanol

Names & synonyms

SCHEMBL11728674HMSQCAPBQMYPMV-UHFFFAOYSA-N2-(2-Hydroxymethylamino-5-thiadiazolyl)-1-methyl-5-nitroimidazole

Database identifiers

PubChem CID
21390852

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
136 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
3
Heavy atoms
17

Related reactions

3 records
New reaction record

Compound notes

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