TAK-659 hydrochloride | CAS 1312691-41-0;1952251-28-3 | AnyMole

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HIT212020678

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HIT212020678

HIT ID:HIT212020678
Cas No:1312691-41-0;1952251-28-3
常用名:TAK-659 hydrochloride
IUPAC:6-{[(1R,2S)-2-aminocyclohexyl]amino}-7-fluoro-4-(1-methyl-1H-pyrazol-4-yl)-1H,2H,3H-pyrrolo[3,4-c]pyridin-3-one hydrochloride
IUPAC:6-{[(1R,2S)-2-aminocyclohexyl]amino}-7-fluoro-4-(1-methyl-1H-pyrazol-4-yl)-1H,2H,3H-pyrrolo[3,4-c]pyridin-3-one hydrochloride
InChI key:PTCFBXMEFRIEGV-ZVWHLABXSA-N

分子式:C17H22ClFN6O
分子量:380.85
氢键供体数 (HBD):3
氢键受体数 (HBA):5
LogP:0.86947554
SMILES:Cl.Cn1cc(cn1)-c1nc(N[C@@H]2CCCC[C@@H]2N)c(F)c2CNC(=O)c12
SMILES:Cl.Cn1cc(cn1)-c1nc(N[C@@H]2CCCC[C@@H]2N)c(F)c2CNC(=O)c12

TAK-659 is an inhibitor of spleen tyrosine kinase (syk), with potential anti-inflammatory, immunomodulating, and antineoplastic activities. Spleen tyrosine kinase inhibitor TAK-659 may inhibit the activity of syk, which abrogates downstream B-cell receptor (BCR) signaling and leads to an inhibition of B-cell activation, chemotaxis, adhesion and proliferation. Note: TAK-659 free base is less stable. This product is supplied as dihydrochloride form.

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