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Chemical structure of PF-02413873

GC63143

PF-02413873

Also known as 4-[3-cyclopropyl-5-methyl-1-(methylsulfonylmethyl)pyrazol-4-yl]oxy-2,6-dimethylbenzonitrile

PF-02413873 (PF-2413873) is a potent selective, fully competitive and orally active nonsteroidal progesterone receptor (PR) antagonist, with a Ki of 2·6 nM

ChemicalCAS936345-35-6MW359.44FormulaC18H21N3O3S
CAS number
936345-35-6
Molecular weight
359.44
Formula
C18H21N3O3S
Solubility
DMSO ： 100 mg/mL (278·21 mM; Need ultrasonic)
InChIKey
QSFGZNVRVZHUGV-UHFFFAOYSA-N
Catalogue number
GC63143
Brand
GLPBIO
Computed properties PubChem CID 16662425 · XLogP 2.6 · TPSA 93.4 Ų · H-bond donors 0
XLogP
2.6
TPSA
93.4 Ų
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
25

SMILES CC1=CC(=CC(=C1C#N)C)OC2=C(N(N=C2C3CC3)CS(=O)(=O)C)C

Computed descriptors from PubChem (CID 16662425), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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