1-({3-[2-(2,4-Dichlorophenyl)ethoxy]-4-methoxyphenyl}carbonyl)-4-(pyridin-4-yl)piperazine

HCID 11329232

Basic information

Standard SMILES
COc1ccc(C(=O)N2CCN(c3ccncc3)CC2)cc1OCCc1ccc(Cl)cc1Cl
InChIKey
GWDRNDFJJHXBAV-UHFFFAOYSA-N
Molecular formula
C25H25Cl2N3O3
Average molar mass
486.4 g/mol

Names & identifiers

Preferred name
1-({3-[2-(2,4-Dichlorophenyl)ethoxy]-4-methoxyphenyl}carbonyl)-4-(pyridin-4-yl)piperazine
IUPAC
[3-[2-(2,4-dichlorophenyl)ethoxy]-4-methoxyphenyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone

Names & synonyms

3-Oxybenzamide 95CHEMBL190670SCHEMBL6067053BDBM13709GWDRNDFJJHXBAV-UHFFFAOYSA-N1-({3-[2-(2,4-dichlorophenyl)ethoxy]-4-methoxyphenyl}carbonyl)-4-(pyridin-4-yl)piperazine{3-[2-(2,4-Dichlorophenyl)-Ethoxy]-4-Methoxy-Phenyl}-(4-Pyridin-4-Yl-Piperazin-1-Yl)-Methanone

Database identifiers

PubChem CID
11329232
ChEMBL
CHEMBL190670

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
54.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
33

Related reactions

3 records

Compound notes

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