3-Cyclopentyloxy-4-methoxyphenyl 3,5-dichloropyrid-4-ylmethyl ketone

HCID 21469578

Basic information

Standard SMILES
COc1ccc(C(=O)Cc2c(Cl)cncc2Cl)cc1OC1CCCC1
InChIKey
PXCWNWXPOWAWKT-UHFFFAOYSA-N
Molecular formula
C19H19Cl2NO3
Average molar mass
380.3 g/mol
Monoisotopic mass
379.0741989

Names & identifiers

Preferred name
3-Cyclopentyloxy-4-methoxyphenyl 3,5-dichloropyrid-4-ylmethyl ketone
IUPAC
1-(3-cyclopentyloxy-4-methoxyphenyl)-2-(3,5-dichloro-4-pyridinyl)ethanone

Names & synonyms

SCHEMBL1028931PXCWNWXPOWAWKT-UHFFFAOYSA-N3-cyclopentyloxy-4-methoxyphenyl 3,5-dichloropyrid-4-ylmethyl ketone1-(3-cyclopentyloxy-4-methoxy-phenyl)-2-(3,5-dichloro -pyridin-4-yl)-ethanone1-(3-cyclopentyloxy-4-methoxy-phenyl)-2-(3,5-dichloro-pyridin-4-yl)-ethanone

Database identifiers

PubChem CID
21469578

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
48.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
25

Related reactions

18 records

Linked notes

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