N-[1-[2-(3-hydroxypiperidin-1-yl)ethyl]piperidin-4-yl]-4-(3-methylphenoxy)-1H-indole-2-carboxamide
Basic information
- Standard SMILES
Cc1cccc(Oc2cccc3[nH]c(C(=O)NC4CCN(CCN5CCCC(O)C5)CC4)cc23)c1- InChIKey
XUFQNBYKDZYOPM-UHFFFAOYSA-N- Molecular formula
- C28H36N4O3
- Average molar mass
- 476.6 g/mol
Names & identifiers
- Preferred name
- N-[1-[2-(3-hydroxypiperidin-1-yl)ethyl]piperidin-4-yl]-4-(3-methylphenoxy)-1H-indole-2-carboxamide
- IUPAC
- N-[1-[2-(3-hydroxypiperidin-1-yl)ethyl]piperidin-4-yl]-4-(3-methylphenoxy)-1H-indole-2-carboxamide
Names & synonyms
SCHEMBL914582SCHEMBL6963601
Database identifiers
- PubChem CID
- 59600153
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 80.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 685
Related reactions
1 records
Compound notes
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