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Chemical structure of A-196

GC32861

A-196

Also known as 6,7-dichloro-N-cyclopentyl-4-pyridin-4-ylphthalazin-1-amine

A selective inhibitor of SUV420H1 and SUV420H2

ChemicalCAS1982372-88-2MW359.25FormulaC18H16Cl2N4
CAS number
1982372-88-2
Molecular weight
359.25
Formula
C18H16Cl2N4
Solubility
DMSO : ≥ 31 mg/mL (86·29 mM)
InChIKey
ABGOSOMRWSYAOB-UHFFFAOYSA-N
Catalogue number
GC32861
Brand
GLPBIO
Computed properties PubChem CID 117072548 · XLogP 4.5 · TPSA 50.7 Ų · H-bond donors 1
XLogP
4.5
TPSA
50.7 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
24

SMILES C1CCC(C1)NC2=NN=C(C3=CC(=C(C=C32)Cl)Cl)C4=CC=NC=C4

Computed descriptors from PubChem (CID 117072548), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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