N-[2-(Hydroxymethyl)-3-pyridinyl]-2-[(phenylmethyl)oxy]-5-(4-pyridinyl)benzamide

HCID 69936751
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Basic information

Standard SMILES
O=C(Nc1cccnc1CO)c1cc(-c2ccncc2)ccc1OCc1ccccc1
InChIKey
ZIBBLYYUCCKCOZ-UHFFFAOYSA-N
Molecular formula
C25H21N3O3
Average molar mass
411.5 g/mol
Monoisotopic mass
411.15829154

Names & identifiers

Preferred name
N-[2-(Hydroxymethyl)-3-pyridinyl]-2-[(phenylmethyl)oxy]-5-(4-pyridinyl)benzamide
IUPAC
N-[2-(hydroxymethyl)-3-pyridinyl]-2-phenylmethoxy-5-pyridin-4-ylbenzamide

Names & synonyms

SCHEMBL6918292ZIBBLYYUCCKCOZ-UHFFFAOYSA-NN-[2-(Hydroxymethyl)-3-pyridinyl]-2-[(phenylmethyl)oxy]-5-(4-pyridinyl)benzamide

Database identifiers

PubChem CID
69936751

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
84.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
31

Related reactions

1 records
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Compound notes

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