(4-Pyridin-4-yl-pyrimidin-2-yl)-[3-(1,1,2,2-tetrafluoro-ethoxy)-phenyl]-amine

HCID 9799152

Basic information

Standard SMILES
FC(F)C(F)(F)Oc1cccc(Nc2nccc(-c3ccncc3)n2)c1
InChIKey
RUZDLQFYMAFCOE-UHFFFAOYSA-N
Molecular formula
C17H12F4N4O
Average molar mass
364.3 g/mol
Monoisotopic mass
364.09472367

Names & identifiers

Preferred name
(4-Pyridin-4-yl-pyrimidin-2-yl)-[3-(1,1,2,2-tetrafluoro-ethoxy)-phenyl]-amine
IUPAC
4-pyridin-4-yl-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]pyrimidin-2-amine

Names & synonyms

CHEMBL55662(4-Pyridin-4-yl-pyrimidin-2-yl)-[3-(1,1,2,2-tetrafluoro-ethoxy)-phenyl]-amineSCHEMBL1269BDBM50290420N-[3-(1,1,2,2-tetrafluoro-ethoxy)-phenyl]-4(4-pyridyl)-2-pyrimidineamineN-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4-(4-pyridyl)-2-pyrimidine-amine

Database identifiers

PubChem CID
9799152
ChEMBL
CHEMBL55662
Nikkaji
J764.285G

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
59.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
6
Heavy atoms
26

Related reactions

4 records

Compound notes

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