1-[Bis(4-chlorophenyl)methyl]-3-[1-(3,5-difluorophenyl)-2,2-dimethylpropylidene]azetidine

HCID 11236799
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Basic information

Standard SMILES
CC(C)(C)C(=C1CN(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1)c1cc(F)cc(F)c1
InChIKey
VQTHRBZQEBYBNL-UHFFFAOYSA-N
Molecular formula
C27H25Cl2F2N
Average molar mass
472.4 g/mol
Monoisotopic mass
471.1332115

Names & identifiers

Preferred name
1-[Bis(4-chlorophenyl)methyl]-3-[1-(3,5-difluorophenyl)-2,2-dimethylpropylidene]azetidine
IUPAC
1-[bis(4-chlorophenyl)methyl]-3-[1-(3,5-difluorophenyl)-2,2-dimethylpropylidene]azetidine

Names & synonyms

SCHEMBL1528992VQTHRBZQEBYBNL-UHFFFAOYSA-N1-[bis(4-chlorophenyl)methyl]-3-[1-(3,5-difluorophenyl)-2,2-dimethylpropylidene]azetidine

Database identifiers

PubChem CID
11236799

Properties

Computed structural properties

XLogP
8.2
Topological polar surface area
3.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
32

Related reactions

3 records
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Compound notes

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