1-(3-bromophenyl)-2-hydroxymethyl-5-(4-methoxy-benzyloxy)-1H-pyridin-4-one

HCID 67417962

Basic information

Standard SMILES
COc1ccc(COc2cn(-c3cccc(Br)c3)c(CO)cc2=O)cc1
InChIKey
ZZHQPTPEDVDNQQ-UHFFFAOYSA-N
Molecular formula
C20H18BrNO4
Average molar mass
416.3 g/mol

Names & identifiers

Preferred name
1-(3-bromophenyl)-2-hydroxymethyl-5-(4-methoxy-benzyloxy)-1H-pyridin-4-one
IUPAC
1-(3-bromophenyl)-2-(hydroxymethyl)-5-[(4-methoxyphenyl)methoxy]pyridin-4-one

Names & synonyms

SCHEMBL2463639ZZHQPTPEDVDNQQ-UHFFFAOYSA-N1-(3-bromo-phenyl)-2-hydroxymethyl-5-(4-methoxy-benzyloxy)-1H-pyridin-4-one1-(3-bromophenyl)-2-hydroxymethyl-5-(4-methoxy-benzyloxy)-1H-pyridin-4-one

Database identifiers

PubChem CID
67417962

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
59 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
26

Related reactions

3 records

Compound notes

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