4-(Furan-3-ylmethoxy)-1H-indole-2-carboxylic acid {1-[(S)-2-(4-hydroxy-piperidin-1-yl)-propyl]-piperidin-4-yl}-amide
Basic information
- Standard SMILES
C[C@@H](CN1CCC(NC(=O)c2cc3c(OCc4ccoc4)cccc3[nH]2)CC1)N1CCC(O)CC1- InChIKey
ZDMOJAKIJLDPIT-IBGZPJMESA-N- Molecular formula
- C27H36N4O4
- Average molar mass
- 480.6 g/mol
- Monoisotopic mass
- 480.27365564
Names & identifiers
- Preferred name
- 4-(Furan-3-ylmethoxy)-1H-indole-2-carboxylic acid {1-[(S)-2-(4-hydroxy-piperidin-1-yl)-propyl]-piperidin-4-yl}-amide
- IUPAC
- 4-(furan-3-ylmethoxy)-N-[1-[(2S)-2-(4-hydroxypiperidin-1-yl)propyl]piperidin-4-yl]-1H-indole-2-carboxamide
Names & synonyms
SCHEMBL914713ZDMOJAKIJLDPIT-IBGZPJMESA-N4-(Furan-3-ylmethoxy)-1H-indole-2-carboxylic acid {1-[(S)-2-(4-hydroxy-piperidin-1-yl)-propyl]-piperidin-4-yl}-amide
Database identifiers
- PubChem CID
- 11477166
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 94 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 680
Related reactions
2 records
Compound notes
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