5-(1-piperidyl)-1-[7-[5-(1-piperidyl)pentanoyl]-9H-xanthen-2-yl]pentan-1-one

HCID 515403

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

Related reactions

3 records

Compound notes

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