1-[(2-Methoxyquinolin-3-yl)aminothiocarbonyl]-4-(3,5-dimethoxyphenyl)piperazine

HCID 53854089
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Basic information

Standard SMILES
COc1cc(OC)cc(N2CCN(C(=S)Nc3cc4ccccc4nc3OC)CC2)c1
InChIKey
GRXDYJTXZFMAMM-UHFFFAOYSA-N
Molecular formula
C23H26N4O3S
Average molar mass
438.5 g/mol

Names & identifiers

Preferred name
1-[(2-Methoxyquinolin-3-yl)aminothiocarbonyl]-4-(3,5-dimethoxyphenyl)piperazine
IUPAC
4-(3,5-dimethoxyphenyl)-N-(2-methoxyquinolin-3-yl)piperazine-1-carbothioamide

Names & synonyms

SCHEMBL6652797GRXDYJTXZFMAMM-UHFFFAOYSA-N1-[(2-Methoxyquinolin-3-yl)aminothiocarbonyl]-4-(3,5-dimethoxyphenyl)piperazine

Database identifiers

PubChem CID
53854089

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
91.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
31

Related reactions

1 records
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Compound notes

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