6-[1-Hydroxy-2-methyl-1-(1-trityl-1H-imidazol-4-yl)propyl]naphthalen-2-yloxymethyl 2,2-dimethylpropionate

HCID 22018428
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Basic information

Standard SMILES
CC(C)C(O)(c1ccc2cc(OCOC(=O)C(C)(C)C)ccc2c1)c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1
InChIKey
CCDWNXNUUGYUBQ-UHFFFAOYSA-N
Molecular formula
C42H42N2O4
Average molar mass
638.8 g/mol

Names & identifiers

Preferred name
6-[1-Hydroxy-2-methyl-1-(1-trityl-1H-imidazol-4-yl)propyl]naphthalen-2-yloxymethyl 2,2-dimethylpropionate
IUPAC
[6-[1-hydroxy-2-methyl-1-(1-tritylimidazol-4-yl)propyl]naphthalen-2-yl]oxymethyl 2,2-dimethylpropanoate

Names & synonyms

SCHEMBL5751453CCDWNXNUUGYUBQ-UHFFFAOYSA-N6-[1-Hydroxy-2-methyl-1-(1-trityl-1H-imidazol-4-yl)propyl]naphthalen-2-yloxymethyl 2,2-dimethylpropionate

Database identifiers

PubChem CID
22018428

Properties

Computed structural properties

XLogP
9.4
Topological polar surface area
73.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
12
Heavy atoms
48

Related reactions

3 records
New reaction record

Compound notes

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