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Chemical structure of CAY10701

GC40890

CAY10701

Also known as 6-benzoyl-2-pent-4-ynyl-5-phenyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one

CAY10701 is a 7-deazahypoxanthine analog that prevents microtubule formation, blocking the proliferation of HeLa and MCF-7 cells (GI50s = 22 and 38 nM, respectively)

ChemicalCAS1616967-52-2MW381.4FormulaC24H19N3O2
CAS number
1616967-52-2
Molecular weight
381.4
Formula
C24H19N3O2
Solubility
Ethanol： 10 mg/ml,Methanol： 10 mg/ml
InChIKey
ZRRBLKLCAVULNS-UHFFFAOYSA-N
Catalogue number
GC40890
Brand
GLPBIO
Computed properties PubChem CID 136053645 · XLogP 4 · TPSA 74.3 Ų · H-bond donors 2
XLogP
4
TPSA
74.3 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
29

SMILES C#CCCCC1=NC2=C(C(=C(N2)C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)N1

Computed descriptors from PubChem (CID 136053645), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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