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Chemical structure of 3BrB-PP1

GC74922

3BrB-PP1

Also known as 3-[(3-bromophenyl)methyl]-1-tert-butylpyrazolo[3,4-d]pyrimidin-4-amine

3BrB-PP1 is an ATP-competitive analog

ChemicalCAS956025-99-3MW360.25FormulaC16H18BrN5
CAS number
956025-99-3
Molecular weight
360.25
Formula
C16H18BrN5
Solubility
DMSO: 100 mg/mL (277·59 mM; Need ultrasonic)
InChIKey
FTICVONBLRGQJW-UHFFFAOYSA-N
Catalogue number
GC74922
Brand
GLPBIO
Computed properties PubChem CID 24865027 · XLogP 3.4 · TPSA 69.6 Ų · H-bond donors 1
XLogP
3.4
TPSA
69.6 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
22

SMILES CC(C)(C)N1C2=NC=NC(=C2C(=N1)CC3=CC(=CC=C3)Br)N

Computed descriptors from PubChem (CID 24865027), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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