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UNC7145

CAT: 0013-GTR19232652-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19232652-01Size:50 mg
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Description
UNC6934 Negative Control (Axon 3591) is a structurally analogous compound used as a negative control for the NSD2-PWWP1 domain probe UNC6934. This tool compound is essential for validating target-specific effects in biochemical, cellular, and in vivo studies of epigenetic regulation and cancer biology.
CAS Number
2561494-78-6
Field of Research
Epigenetics & Chromatin
Smiles
CC (C) N (Cc1ccc (cc1) C (=O) Nc1ccncn1) C (=O) c1ccc2NC (=O) COc2c1
Molecular Formula
C24H23N5O4
Molecular Weight
445.4705
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-oxo-N-(propan-2-yl)-N-((4-((pyrimidin-4-yl)carbamoyl)phenyl)methyl)-3,4-dihydro-2H-1,4-benzoxazine-7-carboxamide
CAS Number2561494-78-6
PubChem CID156587156
IUPAC Name3-oxo-N-propan-2-yl-N-[[4-(pyrimidin-4-ylcarbamoyl)phenyl]methyl]-4H-1,4-benzoxazine-7-carboxamide
Molecular FormulaC24H23N5O4
Molecular Weight445.5
XLogP2.1
Topological Polar Surface Area114
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity709
SMILES
CC(C)N(CC1=CC=C(C=C1)C(=O)NC2=NC=NC=C2)C(=O)C3=CC4=C(C=C3)NC(=O)CO4
InChI
InChI=1S/C24H23N5O4/c1-15(2)29(24(32)18-7-8-19-20(11-18)33-13-22(30)27-19)12-16-3-5-17(6-4-16)23(31)28-21-9-10-25-14-26-21/h3-11,14-15H,12-13H2,1-2H3,(H,27,30)(H,25,26,28,31)
InChIKey
HUIINGSTUYTZJL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-oxo-N-(propan-2-yl)-N-((4-((pyrimidin-4-yl)carbamoyl)phenyl)methyl)-3,4-dihydro-2H-1,4-benzoxazine-7-carboxamide
CAS: 2561494-78-6
CID: 156587156
Formula: C24H23N5O4
MW: 445.5
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight445.5
XLogP32.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass445.17500423
Monoisotopic Mass445.17500423
Topological Polar Surface Area114 Ų
Heavy Atom Count33
Formal Charge0
Complexity709
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

Alternative Products

CatalogName
HY-155221-01UNC7145

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