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P62-mediated mitophagy inducer 25mg

CAT: 0628-A18907-25Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0628-A18907-25Size:25 mg
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CAS Number
1809031-84-2

Chemical Information

1-(3-iodophenyl)-4-(3-nitrophenyl)-1H-1,2,3-triazole
CAS Number1809031-84-2
PubChem CID122190591
IUPAC Name1-(3-iodophenyl)-4-(3-nitrophenyl)triazole
Molecular FormulaC14H9IN4O2
Molecular Weight392.15
XLogP3.5
Topological Polar Surface Area76.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity378
SMILES
C1=CC(=CC(=C1)[N+](=O)[O-])C2=CN(N=N2)C3=CC(=CC=C3)I
InChI
InChI=1S/C14H9IN4O2/c15-11-4-2-5-12(8-11)18-9-14(16-17-18)10-3-1-6-13(7-10)19(20)21/h1-9H
InChIKey
LSVWEYNSNZJEGB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(3-iodophenyl)-4-(3-nitrophenyl)-1H-1,2,3-triazole
CAS: 1809031-84-2
CID: 122190591
Formula: C14H9IN4O2
MW: 392.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight392.15
XLogP33.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass391.97702
Monoisotopic Mass391.97702
Topological Polar Surface Area76.5 Ų
Heavy Atom Count21
Formal Charge0
Complexity378
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