7-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butoxy)-3,4-dihydroquinolin-2(1H)-one

HCID 10692886

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Basic information

Standard SMILES: COc1ccccc1N1CCN(CCCCOc2ccc3c(c2)NC(=O)CC3)CC1
InChIKey: HVSUPPZVIPTMEM-UHFFFAOYSA-N
Molecular formula: C24H31N3O3
Average molar mass: 409.5 g/mol
Monoisotopic mass: 409.23654186

Names & identifiers

Preferred name: 7-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butoxy)-3,4-dihydroquinolin-2(1H)-one
IUPAC: 7-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one

Names & synonyms

7-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butoxy)-3,4-dihydroquinolin-2(1h)-oneMPBDQO cpdRefChem:914208CHEMBL160296129722-23-23,4-Dihydro-7-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butoxy]-2(1H)-quinolinoneCHEMBL1813590SV-III-130sSCHEMBL252295HVSUPPZVIPTMEM-UHFFFAOYSA-NGLXC-01878BDBM50349866

Show more names

7-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one7-(4-(4-(2-Methoxyphenyl)piperazin-1-yl)butyloxy)-3,4-dihydroquinolin-2(1H)-one

Database identifiers

PubChem CID: 10692886
ChEMBL: CHEMBL160296、CHEMBL1813590

Properties

Computed structural properties

XLogP: 3.4
Topological polar surface area: 54 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 8
Heavy atoms: 30
Formal charge: 0
Complexity: 538

Related reactions

1 records

New reaction record

HRID 1750142As productuspto-grants-2015_10

Compound notes

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