Basic information
- CAS
63990-50-1- Standard SMILES
CC(=O)c1ccc(OCC(O)CN2CCN(c3ccccc3)CC2)c(C)c1- InChIKey
WMHPFELNGHYGPL-UHFFFAOYSA-N- Molecular formula
- C22H28N2O3
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.20999276
Names & identifiers
- Preferred name
- Acetophenone, 4'-(2-hydroxy-3-(4-phenylpiperazinyl)propoxy)-3'-methyl-
- IUPAC
- 1-[4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-3-methylphenyl]ethanone
- English name
- 4'-[2-Hydroxy-3-(4-phenylpiperazino)propoxy]-3'-methylacetophenone
- Molecular weight
- 0
Names & synonyms
63990-50-1ACETOPHENONE, 4'-(2-HYDROXY-3-(4-PHENYLPIPERAZINYL)PROPOXY)-3'-METHYL-RefChem:10759421-(4-Acetyl-2-methylphenoxy)-3-(4-phenylpiperazinyl)propan-2-olBRN 0578162NSC147841DTXSID501384430NSC 147841NSC-147841Ethanone, 1-[4-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy]-3-methylphenyl]-DB-2950444'-[2-Hydroxy-3-(4-phenylpiperazino)propoxy]-3'-methylacetophenone
Database identifiers
- CAS
63990-50-1- PubChem CID
- 46162
- DTXSID
DTXSID501384430- Nikkaji
- J90.753G
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 53 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 458
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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