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Chemical structure of PD 81723

GC10103

PD 81723

Also known as (2-amino-4,5-dimethylthiophen-3-yl)-[3-(trifluoromethyl)phenyl]methanone

Allosteric potentiator at the adenosine A1 receptor

ChemicalCAS132861-87-1MW299.31FormulaC14H12F3NOS
CAS number
132861-87-1
Molecular weight
299.31
Formula
C14H12F3NOS
Solubility
＜29·93mg/ml in DMSO; ＜29·93mg/ml in ethanol
InChIKey
KKDKAWKYGCUOGR-UHFFFAOYSA-N
Catalogue number
GC10103
Brand
GLPBIO
Computed properties PubChem CID 122028 · XLogP 4.8 · TPSA 71.3 Ų · H-bond donors 1
XLogP
4.8
TPSA
71.3 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
20

SMILES CC1=C(SC(=C1C(=O)C2=CC(=CC=C2)C(F)(F)F)N)C

Computed descriptors from PubChem (CID 122028), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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