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UNC7145

CAT: 0804-HY-155221-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-155221-03Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
UNC7145 is an inactive derivative of UNC6934 that can be used as a negative control for the protein-protein inhibition activity of UNC6934.
CAS Number
2561494-78-6
UNSPSC
12352005
Hazard Statement
H315-H319-H335
Target
Histone Methyltransferase
Related Pathways
Epigenetics
Field of Research
Cancer
Smiles
O=C(C1=CC=C(CN(C(C)C)C(C2=CC=C3NC(COC3=C2)=O)=O)C=C1)NC4=CC=NC=N4
Molecular Formula
C24H23N5O4
Molecular Weight
445.47
Precautions
P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362-P403+P233-P405-P501
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

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
Loading 3D structure...
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
533690UNC7145

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