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Chemical structure of NR2F1 agonist 1

GC73285

NR2F1 agonist 1

Also known as 16-ethylsulfanyl-12-(2-phenylethyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one

NR2F1 agonist 1, a nuclear receptor NR2F1 agonist, specifically activates dormancy programs in malignant cells

ChemicalCAS374101-64-1MW470.63FormulaC28H30N4OS
CAS number
374101-64-1
Molecular weight
470.63
Formula
C28H30N4OS
Solubility
DMSO ： 7·5 mg/mL (15·94 mM; ultrasonic and warming and heat to 60°C)
InChIKey
YMOYEJYEEJZQCT-UHFFFAOYSA-N
Catalogue number
GC73285
Brand
GLPBIO
Computed properties PubChem CID 1908810 · XLogP 6.5 · TPSA 76.3 Ų · H-bond donors 0
XLogP
6.5
TPSA
76.3 Ų
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
34

SMILES CCSC1=NN=C2N1C3=C(C(=O)N2CCC4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63

Computed descriptors from PubChem (CID 1908810), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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