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TNG908

CAT: 1410-M36534-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M36534-01Size:5 mg
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Description
TNG908 is an orally active and selective MTAP-co-PRMT5 inhibitor that crosses the blood-brain barrier and kills MTAP-deficient cancers.
CAS Number
2760481-53-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
409.51
Molecular Formula
C21H23N5O2S
Notes
Research use only, not for human use.
Receptor
Histone Methyltransferase

Chemical Information

N-(6-Amino-5-Methylpyridin-3-Yl)-2-((2R,5S)-2-(Benzo[D]Thiazol-5-Yl)-5-Methylpiperidin-1-Yl)-2-Oxoacetamide

TNG908 is a small molecule inhibitor of protein arginine methyl transferase 5 (PRMT5).

CAS Number2760481-53-4
PubChem CID164753116
IUPAC NameN-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5S)-2-(1,3-benzothiazol-5-yl)-5-methylpiperidin-1-yl]-2-oxoacetamide
Molecular FormulaC21H23N5O2S
Molecular Weight409.5
XLogP3.2
Topological Polar Surface Area129
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count29
Formal Charge0
Complexity620
SMILES
C[C@H]1CC[C@@H](N(C1)C(=O)C(=O)NC2=CN=C(C(=C2)C)N)C3=CC4=C(C=C3)SC=N4
InChI
InChI=1S/C21H23N5O2S/c1-12-3-5-17(14-4-6-18-16(8-14)24-11-29-18)26(10-12)21(28)20(27)25-15-7-13(2)19(22)23-9-15/h4,6-9,11-12,17H,3,5,10H2,1-2H3,(H2,22,23)(H,25,27)/t12-,17+/m0/s1
InChIKey
NXXBDYHMHHINFC-YVEFUNNKSA-N
Chemical Structure
2D Structure
2D structure of N-(6-Amino-5-Methylpyridin-3-Yl)-2-((2R,5S)-2-(Benzo[D]Thiazol-5-Yl)-5-Methylpiperidin-1-Yl)-2-Oxoacetamide
CAS: 2760481-53-4
CID: 164753116
Formula: C21H23N5O2S
MW: 409.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight409.5
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass409.15724617
Monoisotopic Mass409.15724617
Topological Polar Surface Area129 Ų
Heavy Atom Count29
Formal Charge0
Complexity620
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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