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Chemical structure of TNO155

GC39514

TNO155

Also known as (3S,4S)-8-[6-amino-5-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]pyrazin-2-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine

TNO155 is a potent selective and orally active allosteric inhibitor of wild-type SHP2 (IC50=0·011 μM)· TNO155 has the potential for the study of RTK-dependent malignancies, especially advanced solid tumors

ChemicalCAS1801765-04-7MW421.95FormulaC18H24ClN7OS
CAS number
1801765-04-7
Molecular weight
421.95
Formula
C18H24ClN7OS
Solubility
DMSO： 250 mg/mL (592·49 mM)
InChIKey
UCJZOKGUEJUNIO-IINYFYTJSA-N
Catalogue number
GC39514
Brand
GLPBIO
Computed properties PubChem CID 118238370 · XLogP 1.3 · TPSA 155 Ų · H-bond donors 3
XLogP
1.3
TPSA
155 Ų
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
3
Heavy atoms
28

SMILES C[C@H]1[C@H](C2(CCN(CC2)C3=CN=C(C(=N3)N)SC4=C(C(=NC=C4)N)Cl)CO1)N

Computed descriptors from PubChem (CID 118238370), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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