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Chemical structure of TAS2R14 agonist-2

GC75499

TAS2R14 agonist-2

Also known as 4-methyl-N-[2-(2H-tetrazol-5-yl)phenyl]-6-(trifluoromethyl)pyrimidin-2-amine

TAS2R14 agonist-2 (compound 28·1) is a potent and selective TAS2R14 inhibitor with an EC50 value of 72 nM

ChemicalCAS2883007-69-8MW321.26FormulaC13H10F3N7
CAS number
2883007-69-8
Molecular weight
321.26
Formula
C13H10F3N7
Solubility
DMSO: 20 mg/mL (62·25 mM; Need ultrasonic)
InChIKey
XXKGCSWBGJTTJM-UHFFFAOYSA-N
Catalogue number
GC75499
Brand
GLPBIO
Computed properties PubChem CID 167312460 · XLogP 2.6 · TPSA 92.3 Ų · H-bond donors 2
XLogP
2.6
TPSA
92.3 Ų
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
3
Heavy atoms
23

SMILES CC1=CC(=NC(=N1)NC2=CC=CC=C2C3=NNN=N3)C(F)(F)F

Computed descriptors from PubChem (CID 167312460), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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