Basic information
- Standard SMILES
COc1ccc(C(=O)C2CNCCN2CC2(C)Cc3c(C)c(N)c(C)c(C)c3O2)cc1- InChIKey
NFARBXUNGTYDNG-UHFFFAOYSA-N- Molecular formula
- C25H33N3O3
- Average molar mass
- 423.5 g/mol
Names & identifiers
- Preferred name
- 2,3-Dihydro-2-[[-(4-methoxybenzoyl)-1-piperazinyl]methyl]-2,4,6,7-tetramethyl-5-benzofuranamine
- IUPAC
- [1-[(5-amino-2,4,6,7-tetramethyl-3H-1-benzofuran-2-yl)methyl]piperazin-2-yl]-(4-methoxyphenyl)methanone
Names & synonyms
SCHEMBL7987263NFARBXUNGTYDNG-UHFFFAOYSA-N2,3-Dihydro-2-[[-(4-methoxybenzoyl)-1-piperazinyl]methyl]-2,4,6,7-tetramethyl-5-benzofuranamine
Database identifiers
- PubChem CID
- 22110975
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 76.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 638
Related reactions
2 records
Compound notes
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