Basic information
- Standard SMILES
CCOC(=O)COc1ccc(C(=O)CN2CCN(c3ccncc3)CC2)cc1- InChIKey
QSULKOVSGUVSGR-UHFFFAOYSA-N- Molecular formula
- C21H25N3O4
- Average molar mass
- 383.4 g/mol
Names & identifiers
- Preferred name
- Ethyl 4-[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]phenoxyacetate
- IUPAC
- ethyl 2-[4-[2-(4-pyridin-4-ylpiperazin-1-yl)acetyl]phenoxy]acetate
Names & synonyms
SCHEMBL7401601QSULKOVSGUVSGR-UHFFFAOYSA-NEthyl 4-[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]phenoxyacetateEthyl-4-[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]phenoxyacetateEthyl 4-[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]-phenoxyacetate
Database identifiers
- PubChem CID
- 18918266
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 72 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 494
Related reactions
6 records
Linked notes
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