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Oditrasertib

CAT: 0013-GTR19210291-03Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210291-03Size:5 mg
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Description
Oditasertib (DNL-788) is a potent and selective RIPK1 inhibitor (IC50 < 100 nM) . It is a research tool for investigating RIPK1-driven pathologies, with applications in preclinical studies of neurological and inflammatory diseases, including multiple sclerosis and Alzheimer's disease.
CAS Number
2252271-93-3
Product Name Alternative
ADA 07, ADA-07, DNL-788, Oditrasertib, RIP kinase, RIPK1, RIPkinase
Field of Research
Cell Biology, Signal Transduction
Purity
98.00% (May vary between batches)
Solubility
DMSO:80 mg/mL (270.93 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:3.3 mg/mL (11.18 mM)
Smiles
N#CC1=CN=CC2=C1OCCN (C (=O) C (C) (C) C (F) F) C2
Molecular Formula
C14H15F2N3O2
Molecular Weight
295.28
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Oditrasertib

Oditrasertib is a small molecule drug. The usage of the INN stem '-sertib' in the name indicates that Oditrasertib is a serine/threonine kinase inhibitor. Oditrasertib is under investigation in clinical trial NCT05630547 (A Study to Evaluate the Effect of SAR443820 on Serum Neurofilament Levels in Male and Female Adult Participants With Multiple Sclerosis). Oditrasertib has a monoisotopic molecular weight of 295.11 Da.

CAS Number2252271-93-3
PubChem CID135382587
IUPAC Name4-(3,3-difluoro-2,2-dimethylpropanoyl)-3,5-dihydro-2H-pyrido[3,4-f][1,4]oxazepine-9-carbonitrile
Molecular FormulaC14H15F2N3O2
Molecular Weight295.28
XLogP1.3
Topological Polar Surface Area66.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity447
SMILES
CC(C)(C(F)F)C(=O)N1CCOC2=C(C=NC=C2C1)C#N
InChI
InChI=1S/C14H15F2N3O2/c1-14(2,12(15)16)13(20)19-3-4-21-11-9(5-17)6-18-7-10(11)8-19/h6-7,12H,3-4,8H2,1-2H3
InChIKey
CSCLQCHKUAMZOY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Oditrasertib
CAS: 2252271-93-3
CID: 135382587
Formula: C14H15F2N3O2
MW: 295.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight295.28
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass295.11323305
Monoisotopic Mass295.11323305
Topological Polar Surface Area66.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity447
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
BUP07920-01Oditrasertib

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