6-Bromo-7-{4-[4-(2,3-dichloro-phenyl)-piperazin-1-yl]-butoxy}-3,4-dihydro-1H-[1,8]naphthyridin-2-one

HCID 21073449
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Basic information

Standard SMILES
O=C1CCc2cc(Br)c(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)nc2N1
InChIKey
SAGFAFACOXRHCU-UHFFFAOYSA-N
Molecular formula
C22H25BrCl2N4O2
Average molar mass
528.3 g/mol
Monoisotopic mass
526.05379

Names & identifiers

Preferred name
6-Bromo-7-{4-[4-(2,3-dichloro-phenyl)-piperazin-1-yl]-butoxy}-3,4-dihydro-1H-[1,8]naphthyridin-2-one
IUPAC
6-bromo-7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-1,8-naphthyridin-2-one

Names & synonyms

SCHEMBL5369067SAGFAFACOXRHCU-UHFFFAOYSA-N6-Bromo-7-{4-[4-(2,3-dichloro-phenyl)-piperazin-1-yl]-butoxy}-3,4-dihydro-1H-[1,8]naphthyridin-2-one

Database identifiers

PubChem CID
21073449

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
57.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
31

Related reactions

2 records
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Compound notes

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