2-(2-Benzofuranylmethylene)-6-hydroxy-7-[(3-methyl-1-piperidinyl)methyl]-3(2H)-benzofuranone
Basic information
- CAS
929867-16-3- Standard SMILES
CC1CCCN(Cc2c(O)ccc3c2OC(=Cc2cc4ccccc4o2)C3=O)C1- InChIKey
AKGDYBVHNXMFTN-UHFFFAOYSA-N- Molecular formula
- C24H23NO4
- Average molar mass
- 389.4 g/mol
- Monoisotopic mass
- 389.16270821
Names & identifiers
- Preferred name
- 2-(2-Benzofuranylmethylene)-6-hydroxy-7-[(3-methyl-1-piperidinyl)methyl]-3(2H)-benzofuranone
- IUPAC
- 2-(1-benzofuran-2-ylmethylidene)-6-hydroxy-7-[(3-methylpiperidin-1-yl)methyl]-1-benzofuran-3-one
Names & synonyms
929867-16-3DTXSID7011200783(2H)-Benzofuranone, 2-(2-benzofuranylmethylene)-6-hydroxy-7-[(3-methyl-1-piperidinyl)methyl]-2-(2-Benzofuranylmethylene)-6-hydroxy-7-[(3-methyl-1-piperidinyl)methyl]-3(2H)-benzofuranone2-[(1-Benzofuran-2-yl)methylidene]-6-hydroxy-7-[(3-methylpiperidin-1-yl)methyl]-1-benzofuran-3(2H)-one
Database identifiers
- CAS
929867-16-3- PubChem CID
- 72166259
- DTXSID
DTXSID701120078
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 649
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Compound notes
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