1-(4-(2-(4-(pyridin-2-ylamino)phenoxy)pyridin-3-yl)-5,6-dihydropyridin-1(2H)-yl)ethanone

HCID 59374262

Notes Reactions

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Basic information

Standard SMILES: CC(=O)N1CC=C(c2cccnc2Oc2ccc(Nc3ccccn3)cc2)CC1
InChIKey: PMNSENSAXPVTRV-UHFFFAOYSA-N
Molecular formula: C23H22N4O2
Average molar mass: 386.4 g/mol
Monoisotopic mass: 386.17427596

Names & identifiers

Preferred name: 1-(4-(2-(4-(pyridin-2-ylamino)phenoxy)pyridin-3-yl)-5,6-dihydropyridin-1(2H)-yl)ethanone
IUPAC: 1-[4-[2-[4-(pyridin-2-ylamino)phenoxy]-3-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]ethanone

Names & synonyms

SCHEMBL2486970PMNSENSAXPVTRV-UHFFFAOYSA-NDB-3906571-(4-(2-(4-(pyridin-2-ylamino)phenoxy)pyridin-3-yl)-5,6-dihydropyridin-1(2H)-yl)ethanone1-[3',6'-Dihydro-2-[4-(2-pyridinylamino)phenoxy][3,4'-bipyridin]-1'(2'H)-yl]ethanone1231923-84-4

Database identifiers

PubChem CID: 59374262

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 67.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 29
Formal charge: 0
Complexity: 573

Related reactions

1 records

New reaction record

HRID 473692As productuspto-grants-2014_01

Compound notes

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