5-Bromo2-(6-dodecyloxypyridin-3-yl)pyrimidine

HCID 17869404
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Basic information

Standard SMILES
CCCCCCCCCCCCOc1ccc(-c2ncc(Br)cn2)cn1
InChIKey
AROYPZGKYGXFPD-UHFFFAOYSA-N
Molecular formula
C21H30BrN3O
Average molar mass
420.4 g/mol

Names & identifiers

Preferred name
5-Bromo2-(6-dodecyloxypyridin-3-yl)pyrimidine
IUPAC
5-bromo-2-(6-dodecoxy-3-pyridinyl)pyrimidine

Names & synonyms

SCHEMBL7882597AROYPZGKYGXFPD-UHFFFAOYSA-N5-bromo2-(6-dodecyloxypyridin-3-yl)pyrimidine5-bromo-2-(6-dodecyloxypyridin-3-yl)pyrimidine

Database identifiers

PubChem CID
17869404

Properties

Computed structural properties

XLogP
7.4
Topological polar surface area
47.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
13
Heavy atoms
26

Related reactions

2 records
New reaction record

Compound notes

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