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Chemical structure of TP-472

GC40628

TP-472

Also known as 3-(6-acetylpyrrolo[1,2-a]pyrimidin-8-yl)-N-cyclopropyl-4-methylbenzamide

TP-472 is an inhibitor of bromodomain BRD9 (Kd = 33 nM; EC50 = 320 nM in a NanoBRET assay)

ChemicalCAS2079895-62-6MW333.4FormulaC20H19N3O2
CAS number
2079895-62-6
Molecular weight
333.4
Formula
C20H19N3O2
Solubility
Soluble in DMSO
InChIKey
RPBMXJHQYJLPDN-UHFFFAOYSA-N
Catalogue number
GC40628
Brand
GLPBIO
Computed properties PubChem CID 123773279 · XLogP 3.6 · TPSA 63.5 Ų · H-bond donors 1
XLogP
3.6
TPSA
63.5 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
25

SMILES CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=C4N=CC=CN4C(=C3)C(=O)C

Computed descriptors from PubChem (CID 123773279), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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