4-[5-(4-tert-Butyl-phenyl)-2-(4-chloro-phenyl)-3H-imidazol-4-yl]-pyridine

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Basic information

Standard SMILES: CC(C)(C)c1ccc(-c2nc(-c3ccc(Cl)cc3)[nH]c2-c2ccncc2)cc1
InChIKey: IOUZABLRGQPIJC-UHFFFAOYSA-N
Molecular formula: C24H22ClN3
Average molar mass: 387.9 g/mol
Monoisotopic mass: 387.1502254

Names & identifiers

Preferred name: 4-[5-(4-tert-Butyl-phenyl)-2-(4-chloro-phenyl)-3H-imidazol-4-yl]-pyridine
IUPAC: 4-[4-(4-tert-butylphenyl)-2-(4-chlorophenyl)-1H-imidazol-5-yl]pyridine

Names & synonyms

CHEMBL315800SCHEMBL2647164IOUZABLRGQPIJC-UHFFFAOYSA-NBDBM501043544-(4-t-Butylphenyl)-2-(4-chlorophenyl)-5-(4-pyridyl)imidazole4-[5-(4-tert-Butyl-phenyl)-2-(4-chloro-phenyl)-3H-imidazol-4-yl]-pyridine

Database identifiers

PubChem CID: 9843239
ChEMBL: CHEMBL315800
Nikkaji: J2.382.034J

Properties

Computed structural properties

XLogP: 6.3
Topological polar surface area: 41.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 28
Formal charge: 0
Complexity: 483

Related reactions

1 records

New reaction record

HRID 1418053As productuspto-grants-1999_03

Compound notes

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