cis-5-(2-Chlorophenyl)-3-(4-chlorophenyl)-3-(1H-imidazol-1-ylmethyl)-2-methylisoxazolidine

HCID 516644

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Basic information

CAS: 113614-52-1
Standard SMILES: CN1O[C@H](c2ccccc2Cl)C[C@@]1(Cn1ccnc1)c1ccc(Cl)cc1
InChIKey: KNAWZCVEJBHREV-VQTJNVASSA-N
Molecular formula: C20H19Cl2N3O
Average molar mass: 388.3 g/mol
Monoisotopic mass: 387.0905176

Names & identifiers

Preferred name: cis-5-(2-Chlorophenyl)-3-(4-chlorophenyl)-3-(1H-imidazol-1-ylmethyl)-2-methylisoxazolidine
IUPAC: (3S,5S)-5-(2-chlorophenyl)-3-(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-1,2-oxazolidine

Names & synonyms

cis-5-(2-Chlorophenyl)-3-(4-chlorophenyl)-3-(1H-imidazol-1-ylmethyl)-2-methylisoxazolidine113614-52-1DTXSID00150493RefChem:334235DTXCID0072984CHEMBL294128(3S,5S)-5-(2-chlorophenyl)-3-(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-isoxazolidine(3S,5S)-5-(2-Chlorophenyl)-3-(4-chlorophenyl)-3-[(1H-imidazol-1-yl)methyl]-2-methyl-1,2-oxazolidine

Database identifiers

CAS: 113614-52-1
PubChem CID: 516644
DTXSID: DTXSID00150493
ChEMBL: CHEMBL294128

Properties

Computed structural properties

XLogP: 4.3
Topological polar surface area: 30.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 26
Formal charge: 0
Complexity: 474

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