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PZ-2891

CAT: 0013-GTR19168568-02Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19168568-02Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
PZ-2891
CAS Number
2170608-82-7
Product Name Alternative
Inhibitor, inhibit, penetrant pantothenate kinase (PANK), PZ 2891, PZ2891, PZ-2891
Purity
97.16% (May vary between batches)
Solubility
10% DMSO+90% Corn Oil:3.3 mg/mL (9.44 mM) ; DMSO:75 mg/mL (214.64 mM)
Smiles
CC (C) c1ccc (CC (=O) N2CCN (CC2) c2ccc (nn2) C#N) cc1
Molecular Formula
C20H23N5O
Molecular Weight
349.43
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

6-(4-(2-(4-Isopropylphenyl)acetyl)piperazin-1-yl)pyridazine-3-carbonitrile
CAS Number2170608-82-7
PubChem CID132260806
IUPAC Name6-[4-[2-(4-propan-2-ylphenyl)acetyl]piperazin-1-yl]pyridazine-3-carbonitrile
Molecular FormulaC20H23N5O
Molecular Weight349.4
XLogP2.3
Topological Polar Surface Area73.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity512
SMILES
CC(C)C1=CC=C(C=C1)CC(=O)N2CCN(CC2)C3=NN=C(C=C3)C#N
InChI
InChI=1S/C20H23N5O/c1-15(2)17-5-3-16(4-6-17)13-20(26)25-11-9-24(10-12-25)19-8-7-18(14-21)22-23-19/h3-8,15H,9-13H2,1-2H3
InChIKey
LGWDVWIZDPGCFG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-(4-(2-(4-Isopropylphenyl)acetyl)piperazin-1-yl)pyridazine-3-carbonitrile
CAS: 2170608-82-7
CID: 132260806
Formula: C20H23N5O
MW: 349.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight349.4
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass349.19026037
Monoisotopic Mass349.19026037
Topological Polar Surface Area73.1 Ų
Heavy Atom Count26
Formal Charge0
Complexity512
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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A18880-25PZ-2891 25mg
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