2-(METHYLSULFONYL)-3-NITROPYRAZOLO[1,5-A]PYRIDINE

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Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key GGABERHEGSJSIZ-UHFFFAOYSA-N
Smiles CS(=O)(=O)c1nn2ccccc2c1[N+]([O-])=O
InChI
InChI=1S/C8H7N3O4S/c1-16(14,15)8-7(11(12)13)6-4-2-3-5-10(6)9-8/h2-5H,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H7N3O4S1
Molecular Weight 241.02
AlogP 0.65
Hydrogen Bond Acceptor 6.0
Number of Rotational Bond 2.0
Polar Surface Area 94.58
Heavy Atoms 16.0

Cross References

Resources Reference
CAS NUMBER 935859-71-5
NORMAN SUSDAT
PubChem 57806233
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