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Chemical structure of Glucocorticoid receptor modulator 2

GC71075

Glucocorticoid receptor modulator 2

Also known as N-[(2R,3S)-1-[1-(4-fluorophenyl)indazol-5-yl]-4,4-dimethyl-5-oxo-2-phenylpyrrolidin-3-yl]cyclopropanecarboxamide

Glucocorticoid receptor modulator 2 (Example 1) is a glucocorticoid receptor modulator, with an IC50 value less than 100 nM

ChemicalCAS2452396-89-1MW482.55FormulaC29H27FN4O2
CAS number
2452396-89-1
Molecular weight
482.55
Formula
C29H27FN4O2
Solubility
DMSO : 125 mg/mL (259·04 mM; Need ultrasonic; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)
InChIKey
GJNFFVZYGXQBFZ-CLJLJLNGSA-N
Catalogue number
GC71075
Brand
GLPBIO
Computed properties PubChem CID 154598160 · XLogP 4.7 · TPSA 67.2 Ų · H-bond donors 1
XLogP
4.7
TPSA
67.2 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
36

SMILES CC1([C@@H]([C@H](N(C1=O)C2=CC3=C(C=C2)N(N=C3)C4=CC=C(C=C4)F)C5=CC=CC=C5)NC(=O)C6CC6)C

Computed descriptors from PubChem (CID 154598160), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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