BLU2864

CAT: 0013-GTR19213487-05Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19213487-05Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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Description

BLU2864 is a potent and selective ATP-competitive inhibitor of PRKACA (IC50 = 0.3 nM) . It demonstrates anti-tumor activity in preclinical research, supporting its investigation for applications in oncology and polycystic kidney disease models, both in vitro and in vivo.

CAS Number

2810747-89-6

Product Name Alternative

BLU 2864, BLU2864, BLU-2864, PRKACA

Field of Research

Signal Transduction

Purity

97.58% (May vary between batches)

Solubility

10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (4.42 mM) ; DMSO:50 mg/mL (110.51 mM)

Smiles

N (C (=O) C=1C=CC (=NC1) C2=C3C (NC=C3C) =NC=C2) [C@@H]4C=5C (=CC (C (F) F) =CC5F) C[C@@H]4O

Molecular Formula

C24H19F3N4O2

Molecular Weight

452.43

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

CID 164603354

CAS Number	2810747-89-6
PubChem CID	164603354
IUPAC Name	N-[(1R,2S)-5-(difluoromethyl)-7-fluoro-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-6-(3-methyl-1H-pyrrolo[2,3-b]pyridin-4-yl)pyridine-3-carboxamide
Molecular Formula	C24H19F3N4O2
Molecular Weight	452.4
XLogP	3.2
Topological Polar Surface Area	90.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Heavy Atom Count	33
Formal Charge	0
Complexity	715

SMILES

CC1=CNC2=NC=CC(=C12)C3=NC=C(C=C3)C(=O)N[C@H]4[C@H](CC5=C4C(=CC(=C5)C(F)F)F)O

InChI

InChI=1S/C24H19F3N4O2/c1-11-9-30-23-19(11)15(4-5-28-23)17-3-2-12(10-29-17)24(33)31-21-18(32)8-13-6-14(22(26)27)7-16(25)20(13)21/h2-7,9-10,18,21-22,32H,8H2,1H3,(H,28,30)(H,31,33)/t18-,21-/m0/s1

InChIKey

VRPOVDLLZCQZEG-RXVVDRJESA-N

Chemical Structure

2D Structure

CAS: 2810747-89-6

CID: 164603354

Formula: C24H19F3N4O2

MW: 452.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	452.4
XLogP3	3.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	452.14601035
Monoisotopic Mass	452.14601035
Topological Polar Surface Area	90.9 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	715
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
T60170-01	BLU2864

BLU2864

Chemical Information

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