Basic information
- Standard SMILES
O=C(CCCN1CCCCC1)c1ccc2oc3ccc(C(=O)CCCN4CCCCC4)cc3c(=O)c2c1- InChIKey
DCBOTUTWXQWZHT-UHFFFAOYSA-N- Molecular formula
- C31H38N2O4
- Average molar mass
- 502.6 g/mol
Names & identifiers
- Preferred name
- 2,7-Bis(4-piperidinobutyryl)xanthone
- IUPAC
- 2,7-bis(4-piperidin-1-ylbutanoyl)xanthen-9-one
Names & synonyms
SCHEMBL11748405DCBOTUTWXQWZHT-UHFFFAOYSA-N2,7-Bis(4-piperidinobutyryl)xanthone2,7-bis[4-(1-piperidyl)butanoyl]xanthen-9-one2,7-BIS(4-PIPERIDINOBUTYRYL)XANTHEN-9-ONE9H-Xanthen-9-one, 2,7-bis[1-oxo-4-(1-piperidinyl)butyl]-
Database identifiers
- PubChem CID
- 515395
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 726
Related reactions
3 records
Compound notes
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