4-[2-[4-(5,6,7,8-Tetrahydro-4-quinolinyl)piperazin-1-yl]acetyl]phenoxyacetic acid

HCID 18924088
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Basic information

Standard SMILES
O=C(O)COc1ccc(C(=O)CN2CCN(c3ccnc4c3CCCC4)CC2)cc1
InChIKey
VCMIBRUVISJZFK-UHFFFAOYSA-N
Molecular formula
C23H27N3O4
Average molar mass
409.5 g/mol

Names & identifiers

Preferred name
4-[2-[4-(5,6,7,8-Tetrahydro-4-quinolinyl)piperazin-1-yl]acetyl]phenoxyacetic acid
IUPAC
2-[4-[2-[4-(5,6,7,8-tetrahydroquinolin-4-yl)piperazin-1-yl]acetyl]phenoxy]acetic acid

Names & synonyms

SCHEMBL7404196VCMIBRUVISJZFK-UHFFFAOYSA-N4-[2-[4-(5,6,7,8-Tetrahydro-4-quinolinyl)piperazin-1-yl]acetyl]phenoxyacetic acid

Database identifiers

PubChem CID
18924088

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
83 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
7
Heavy atoms
30

Related reactions

2 records
New reaction record

Compound notes

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