Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
3-Benzylidene-1-tritylpiperidin-4-one (HCID 68765714)|Huagongshe
Home
/
Compound
3-Benzylidene-1-tritylpiperidin-4-one
HCID
68765714
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
O=C1CCN(C(c2ccccc2)(c2ccccc2)c2ccccc2)CC1=Cc1ccccc1
InChIKey
ABUBRWDPHNLXIZ-UHFFFAOYSA-N
Molecular formula
C31H27NO
Average molar mass
429.6 g/mol
Names & identifiers
Preferred name
3-Benzylidene-1-tritylpiperidin-4-one
IUPAC
3-benzylidene-1-tritylpiperidin-4-one
Names & synonyms
SCHEMBL3733271
Database identifiers
PubChem CID
68765714
Properties
Computed structural properties
XLogP
6.3
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
33
Formal charge
0
Complexity
611
Show all 8
Show all 8 / 8
Related reactions
2 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
320191
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
682254
As product
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Compound notes
Loading…