Basic information
- CAS
74229-22-4- Standard SMILES
Oc1ccc2oc(CN3CCN(c4ccccc4)CC3)c(-c3ccccc3)c2c1CN1CCN(c2ccccc2)CC1- InChIKey
GXZYCRMIZLDAEK-UHFFFAOYSA-N- Molecular formula
- C36H38N4O2
- Average molar mass
- 558.7 g/mol
- Monoisotopic mass
- 558.29947647
Names & identifiers
- Preferred name
- 5-Benzofuranol, 2,4-bis((4-phenyl-1-piperazinyl)methyl)-3-phenyl-
- IUPAC
- 3-phenyl-2,4-bis[(4-phenylpiperazin-1-yl)methyl]-1-benzofuran-5-ol
Names & synonyms
BRN 51933255-BENZOFURANOL, 2,4-BIS((4-PHENYL-1-PIPERAZINYL)METHYL)-3-PHENYL-74229-22-45-Hydroxy-3-phenyl-2,4-di(N-phenylpiperazinomethyl)benzofuranDTXSID70225223RefChem:301206DTXCID701477143-phenyl-2,4-bis[(4-phenylpiperazin-1-yl)methyl]-1-benzofuran-5-ol
Database identifiers
- CAS
74229-22-4- PubChem CID
- 53006
- DTXSID
DTXSID70225223- Nikkaji
- J71.545J
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 809
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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