Basic information
- CAS
84344-59-2- Standard SMILES
COc1ccc(N2CCN(CCCOc3ccc(C=O)cc3)CC2)cc1- InChIKey
LRTJUOWGWFOSHX-UHFFFAOYSA-N- Molecular formula
- C21H26N2O3
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 354.1943427
Names & identifiers
- Preferred name
- Benzaldehyde, 4-(3-(4-(4-methoxyphenyl)-1-piperazinyl)propoxy)-
- IUPAC
- 4-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propoxy]benzaldehyde
Names & synonyms
BRN 4549570BENZALDEHYDE, 4-(3-(4-(4-METHOXYPHENYL)-1-PIPERAZINYL)PROPOXY)-84344-59-24-(3-(4-(4-Methoxyphenyl)-1-piperazinyl)propoxy)benzaldehydeDTXSID30233329RefChem:321191DTXCID801558204-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propoxy}benzaldehyde
Database identifiers
- CAS
84344-59-2- PubChem CID
- 55239
- DTXSID
DTXSID30233329
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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