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CCT373566

CAT: 0013-GTR19184751-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19184751-02Size:5 mg
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Description
CCT373566 is a potent and orally bioavailable BCL6 degrader with an IC50 of 2.2 nM. It demonstrates robust anti-proliferative activity in cellular assays and effectively inhibits tumor growth in animal models, supporting its use in oncology research for studying BCL6-driven lymphomas and cancers.
CAS Number
2378853-66-6
Field of Research
Cell Biology, Pharmacology & Drug Discovery
Smiles
O=C1C2=C (C=3C (N1C) =CC=C (NC4=NC (=NC=C4Cl) N5C[C@@H] (C) C[C@@H] (O) C5) C3) N[C@H] (C (F) (F) CO2) C6CC6
Molecular Formula
C26H29ClF2N6O3
Molecular Weight
547
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cct373566
CAS Number2378853-66-6
PubChem CID146189160
IUPAC Name(2S)-10-[[5-chloro-2-[(3R,5S)-3-hydroxy-5-methylpiperidin-1-yl]pyrimidin-4-yl]amino]-2-cyclopropyl-3,3-difluoro-7-methyl-2,4-dihydro-1H-[1,4]oxazepino[2,3-c]quinolin-6-one
Molecular FormulaC26H29ClF2N6O3
Molecular Weight547.0
XLogP4.2
Topological Polar Surface Area103
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Heavy Atom Count38
Formal Charge0
Complexity954
SMILES
C[C@H]1C[C@H](CN(C1)C2=NC=C(C(=N2)NC3=CC4=C(C=C3)N(C(=O)C5=C4N[C@H](C(CO5)(F)F)C6CC6)C)Cl)O
InChI
InChI=1S/C26H29ClF2N6O3/c1-13-7-16(36)11-35(10-13)25-30-9-18(27)23(33-25)31-15-5-6-19-17(8-15)20-21(24(37)34(19)2)38-12-26(28,29)22(32-20)14-3-4-14/h5-6,8-9,13-14,16,22,32,36H,3-4,7,10-12H2,1-2H3,(H,30,31,33)/t13-,16+,22-/m0/s1
InChIKey
GSGDUDAFETZSPM-IATAILRESA-N
Chemical Structure
2D Structure
2D structure of Cct373566
CAS: 2378853-66-6
CID: 146189160
Formula: C26H29ClF2N6O3
MW: 547.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight547.0
XLogP34.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Exact Mass546.1957728
Monoisotopic Mass546.1957728
Topological Polar Surface Area103 Ų
Heavy Atom Count38
Formal Charge0
Complexity954
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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