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Basic information
- Standard SMILES
COc1ccc2c(COc3cccc4[nH]c(C(=O)NC5CCN(CC(C)N6CCC(O)C(C)C6)CC5)cc34)coc2c1- InChIKey
NJUAFKOBROXUHU-UHFFFAOYSA-N- Molecular formula
- C33H42N4O5
- Average molar mass
- 574.7 g/mol
- Monoisotopic mass
- 574.31552045
Names & identifiers
- IUPAC
- N-[1-[2-(4-hydroxy-3-methylpiperidin-1-yl)propyl]piperidin-4-yl]-4-[(6-methoxy-1-benzofuran-3-yl)methoxy]-1H-indole-2-carboxamide
Database identifiers
- PubChem CID
- 72977260
Properties
Computed structural propertiesFilling in
- XLogP
- 4.9
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 887
Related reactions
1 records
Compound notes
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