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UNC3474

CAT: 0804-HY-156906-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-156906-02Size:10 mg
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Description
UNC3474 is a small molecule ligand, binding with 53BP1. UNC3474 binds the aromatic methyl-lysine binding cage of 53BP1TT, with a dissociation constant (Kd) of 1.0 ± 0.3 μM. UNC3474 inhibits the recruitment of 53BP1 to DSBs by stabilizing a pre-existing autoinhibited state of 53BP1 in cells[1].
CAS Number
1648707-79-2
UNSPSC
12352005
Target
MDM-2/p53
Type
Reference compound
Related Pathways
Apoptosis
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/unc3474.html
Purity
98.15
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
O=C(C1=CC=CC(C(C)C)=C1)NCCCNC(C)(C)C
Molecular Formula
C17H28N2O
Molecular Weight
276.42
References & Citations
[1]Cui G, et al. An autoinhibited state of 53BP1 revealed by small molecule antagonists and protein engineering. bioRxiv [Preprint]. 2023 Jul 18:2023.04.20.534960.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

N-[3-(tert-butylamino)propyl]-3-(propan-2-yl)benzamide
CAS Number1648707-79-2
PubChem CID91970648
IUPAC NameN-[3-(tert-butylamino)propyl]-3-propan-2-ylbenzamide
Molecular FormulaC17H28N2O
Molecular Weight276.4
XLogP3.2
Topological Polar Surface Area41.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Heavy Atom Count20
Formal Charge0
Complexity294
SMILES
CC(C)C1=CC(=CC=C1)C(=O)NCCCNC(C)(C)C
InChI
InChI=1S/C17H28N2O/c1-13(2)14-8-6-9-15(12-14)16(20)18-10-7-11-19-17(3,4)5/h6,8-9,12-13,19H,7,10-11H2,1-5H3,(H,18,20)
InChIKey
CNTJLQUUYDXEFL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[3-(tert-butylamino)propyl]-3-(propan-2-yl)benzamide
CAS: 1648707-79-2
CID: 91970648
Formula: C17H28N2O
MW: 276.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight276.4
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Exact Mass276.220163521
Monoisotopic Mass276.220163521
Topological Polar Surface Area41.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity294
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
GTR19219041-01UNC3474

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