Basic information
- Standard SMILES
O=C(CCCCN1CCCCC1)c1ccc2c(c1)Cc1cc(C(=O)CCCCN3CCCCC3)ccc1O2- InChIKey
YTGJGGNNERSKTB-UHFFFAOYSA-N- Molecular formula
- C33H44N2O3
- Average molar mass
- 516.7 g/mol
Names & identifiers
- Preferred name
- 5-(1-piperidyl)-1-[7-[5-(1-piperidyl)pentanoyl]-9H-xanthen-2-yl]pentan-1-one
- IUPAC
- 5-piperidin-1-yl-1-[7-(5-piperidin-1-ylpentanoyl)-9H-xanthen-2-yl]pentan-1-one
Names & synonyms
SCHEMBL11751985YTGJGGNNERSKTB-UHFFFAOYSA-N2,7-bis(5-piperidinovaleryl)xanthene1-Pentanone, 1,1'-(9H-xanthene-2,7-diyl)bis[5-(1-piperidinyl)-5-(1-piperidyl)-1-[7-[5-(1-piperidyl)pentanoyl]-9H-xanthen-2-yl]pentan-1-one
Database identifiers
- PubChem CID
- 515403
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 685
Related reactions
3 records
Compound notes
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