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8-Cyclodecyl-1-phenyl-3-(3-phenylpropyl)-1,3,8-triazaspiro[4.5]decan-4-one (HCID 19347409)|Huagongshe
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Compound
8-Cyclodecyl-1-phenyl-3-(3-phenylpropyl)-1,3,8-triazaspiro[4.5]decan-4-one
HCID
19347409
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
O=C1N(CCCc2ccccc2)CN(c2ccccc2)C12CCN(C1CCCCCCCCC1)CC2
InChIKey
KFUMYSAGWOSHRW-UHFFFAOYSA-N
Molecular formula
C32H45N3O
Average molar mass
487.7 g/mol
Monoisotopic mass
487.35626307
Names & identifiers
Preferred name
8-Cyclodecyl-1-phenyl-3-(3-phenylpropyl)-1,3,8-triazaspiro[4.5]decan-4-one
IUPAC
8-cyclodecyl-1-phenyl-3-(3-phenylpropyl)-1,3,8-triazaspiro[4.5]decan-4-one
Database identifiers
PubChem CID
19347409
Properties
Computed structural properties
XLogP
8.1
Topological polar surface area
26.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
36
Formal charge
0
Complexity
650
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1 records
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As reactant
As product
As reagent
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As solvent
HRID
101315
As product
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Compound notes
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