Ethyl 3-[4-(4-isopropyl-phenyl)-pyridin-2-yl]-benzoate

HCID 69232425
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Basic information

Standard SMILES
CCOC(=O)c1cccc(-c2cc(-c3ccc(C(C)C)cc3)ccn2)c1
InChIKey
QNOQHEAIBCDIBI-UHFFFAOYSA-N
Molecular formula
C23H23NO2
Average molar mass
345.4 g/mol

Names & identifiers

Preferred name
Ethyl 3-[4-(4-isopropyl-phenyl)-pyridin-2-yl]-benzoate
IUPAC
ethyl 3-[4-(4-propan-2-ylphenyl)-2-pyridinyl]benzoate

Names & synonyms

SCHEMBL4895264QNOQHEAIBCDIBI-UHFFFAOYSA-Nethyl 3-[4-(4-isopropyl-phenyl)-pyridin-2-yl]-benzoate

Database identifiers

PubChem CID
69232425

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
39.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
26

Related reactions

2 records
New reaction record

Compound notes

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