7-(4-(4-(2,3-Dichlorophenyl)piperazin-1-yl)butoxy)quinolin-2-yl dibenzyl phosphate

HCID 56596992
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Basic information

Standard SMILES
O=P(OCc1ccccc1)(OCc1ccccc1)Oc1ccc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2n1
InChIKey
MEMYGSLZSOZJGW-UHFFFAOYSA-N
Molecular formula
C37H38Cl2N3O5P
Average molar mass
706.6 g/mol
Monoisotopic mass
705.1926137

Names & identifiers

Preferred name
7-(4-(4-(2,3-Dichlorophenyl)piperazin-1-yl)butoxy)quinolin-2-yl dibenzyl phosphate
IUPAC
dibenzyl [7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]quinolin-2-yl] phosphate

Names & synonyms

SCHEMBL9979062MEMYGSLZSOZJGW-UHFFFAOYSA-N7-(4-(4-(2,3-dichlorophenyl)piperazin-1-yl)butoxy)quinolin-2-yl dibenzyl phosphate

Database identifiers

PubChem CID
56596992

Properties

Computed structural properties

XLogP
8.5
Topological polar surface area
73.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
15
Heavy atoms
48

Related reactions

2 records
New reaction record

Compound notes

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