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4-POBN

CAT: 0931-T26389-03Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0931-T26389-03Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5351-17-7
Target
Glutathione Peroxidase
Related Pathways
Metabolism
Purity
0.9988
Bioactivity
4-POBN (Myeloperoxidase Inhibitor 1) is a potent and irreversible inhibitor of myeloperoxidase (IC50 = 0.3 μM) . 4-POBN can be used in studies about subacute stroke.
Smiles
NNC(=O)c1ccc(N)cc1
Molecular Formula
C7H9N3O
Molecular Weight
151.17
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-Aminobenzoic acid hydrazide

4-aminobenzohydrazide is an aminobenzoic acid. It has a role as an EC 1.11.2.2 (myeloperoxidase) inhibitor.

CAS Number5351-17-7
PubChem CID21450
IUPAC Name4-aminobenzohydrazide
Molecular FormulaC7H9N3O
Molecular Weight151.17
XLogP-0.7
Topological Polar Surface Area81.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity141
SMILES
C1=CC(=CC=C1C(=O)NN)N
InChI
InChI=1S/C7H9N3O/c8-6-3-1-5(2-4-6)7(11)10-9/h1-4H,8-9H2,(H,10,11)
InChIKey
WPBZMCGPFHZRHJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Aminobenzoic acid hydrazide
CAS: 5351-17-7
CID: 21450
Formula: C7H9N3O
MW: 151.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight151.17
XLogP3-0.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass151.074561919
Monoisotopic Mass151.074561919
Topological Polar Surface Area81.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity141
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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