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Antiparasitic agent-27

CAT: 0013-GTR19264710-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19264710-01Size:10 mg
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Description
Antiparasitic agent-27 (Compound 2) is a potent antiparasitic compound targeting Leishmania infantum with an IC50 of 3.1 μM. It induces cell cycle arrest in the G0/G1 phase and enhances reactive oxygen species (ROS) production to trigger programmed cell death, showing promise for visceral leishmaniasis (VL) research.
CAS Number
3048504-54-4
Field of Research
Immunology & Inflammation, Infectious Disease & Virology
Smiles
O=C (C1=CC=C (O) C=C1) N2CCN (C3=NC=CN=C3) CC2
Molecular Formula
C15H16N4O2
Molecular Weight
284.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(4-Hydroxyphenyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CAS Number3048504-54-4
PubChem CID172469996
IUPAC Name(4-hydroxyphenyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
Molecular FormulaC15H16N4O2
Molecular Weight284.31
XLogP0.8
Topological Polar Surface Area69.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity350
SMILES
C1CN(CCN1C2=NC=CN=C2)C(=O)C3=CC=C(C=C3)O
InChI
InChI=1S/C15H16N4O2/c20-13-3-1-12(2-4-13)15(21)19-9-7-18(8-10-19)14-11-16-5-6-17-14/h1-6,11,20H,7-10H2
InChIKey
VFEUZRDXEYWESK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (4-Hydroxyphenyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CAS: 3048504-54-4
CID: 172469996
Formula: C15H16N4O2
MW: 284.31
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight284.31
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass284.12732577
Monoisotopic Mass284.12732577
Topological Polar Surface Area69.6 Ų
Heavy Atom Count21
Formal Charge0
Complexity350
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