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Chemical structure of PIM1-IN-1

GC65278

PIM1-IN-1

Also known as 2-[10-(2-methoxyethyl)-13-oxa-3,4,6,7,10-pentazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7-tetraen-5-yl]-N-(piperidin-4-ylmethyl)quinolin-8-amine

PIM1-IN-1 is a potent and highly selective PIM1/3 inhibitor, with IC50s of 7, 5530 and 70 nM for PIM1, PIM2, and PIM3, respectively, inhibits the phosphorylation of BAD, a downstream target of PIM, with an EC50 of 262 nM· PIM1-IN-1 shows no obvious effect on FLT3 or hERG binding· Antiproliferative and anti-cancer activity

ChemicalCAS1417630-95-5MW474.56FormulaC25H30N8O2
CAS number
1417630-95-5
Molecular weight
474.56
Formula
C25H30N8O2
Solubility
DMSO ： 45 mg/mL (94·82 mM; Need ultrasonic)
InChIKey
BKDLGAKRAHVMNP-UHFFFAOYSA-N
Catalogue number
GC65278
Brand
GLPBIO
Computed properties PubChem CID 123561371 · XLogP 1.7 · TPSA 102 Ų · H-bond donors 2
XLogP
1.7
TPSA
102 Ų
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
35

SMILES COCCN1CCOC2=C1C=NN3C2=NN=C3C4=NC5=C(C=CC=C5NCC6CCNCC6)C=C4

Computed descriptors from PubChem (CID 123561371), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Lead time
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