(4S,5R)-2-(4-tert-butyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4,5-dihydro-imidazole-1-carbonyl chloride

HCID 57732375

Basic information

Standard SMILES
CCOc1cc(C(C)(C)C)ccc1C1=N[C@@H](c2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)N1C(=O)Cl
InChIKey
KFKCJVFDEBWEKF-LOSJGSFVSA-N
Molecular formula
C28H27Cl3N2O2
Average molar mass
529.9 g/mol

Names & identifiers

Preferred name
(4S,5R)-2-(4-tert-butyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4,5-dihydro-imidazole-1-carbonyl chloride
IUPAC
(4S,5R)-2-(4-tert-butyl-2-ethoxyphenyl)-4,5-bis(4-chlorophenyl)-4,5-dihydroimidazole-1-carbonyl chloride

Names & synonyms

SCHEMBL1382013SCHEMBL30225601KFKCJVFDEBWEKF-LOSJGSFVSA-N(4S,5R)-2-(4-tert-butyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4,5-dihydro-imidazole-1-carbonyl chloride

Database identifiers

PubChem CID
57732375

Properties

Computed structural properties

XLogP
8.4
Topological polar surface area
41.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
35

Related reactions

33 records

Compound notes

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