Basic information
- CAS
64089-36-7- Standard SMILES
O=C(CN1CCN(c2ccccc2)CC1)c1ccc2c(c1)CCO2- InChIKey
IPEVBXHNICIEFQ-UHFFFAOYSA-N- Molecular formula
- C20H22N2O2
- Average molar mass
- 322.4 g/mol
- Monoisotopic mass
- 322.16812795
Names & identifiers
- Preferred name
- 1-(2,3-Dihydro-1-benzofuran-5-yl)-2-(4-phenylpiperazin-1-yl)ethanone
- IUPAC
- 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(4-phenylpiperazin-1-yl)ethanone
Names & synonyms
64089-36-7DTXSID5011593961-(2,3-Dihydro-1-benzofuran-5-yl)-2-(4-phenylpiperazin-1-yl)ethan-1-oneEthanone, 1-(2,3-dihydro-5-benzofuranyl)-2-(4-phenyl-1-piperazinyl)-
Database identifiers
- CAS
64089-36-7- PubChem CID
- 12379545
- DTXSID
DTXSID501159396
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 427
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…