Basic information
- Standard SMILES
O=C(NCc1ccccc1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1- InChIKey
JQDFNIGQDCUZAO-UHFFFAOYSA-N- Molecular formula
- C29H28ClN3O2
- Average molar mass
- 486 g/mol
Names & identifiers
- Preferred name
- N-benzyl-1-(1-(4-chlorobenzyl)-1H-indole-2-carbonyl)piperidine-4-carboxamide
- IUPAC
- N-benzyl-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide
Names & synonyms
CHEMBL3085936SCHEMBL12804739JQDFNIGQDCUZAO-UHFFFAOYSA-NN-benzyl-1-(1-(4-chlorobenzyl)-1H-indole-2-carbonyl)piperidine-4-carboxamide
Database identifiers
- PubChem CID
- 57385296
- ChEMBL
CHEMBL3085936
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 711
Related reactions
1 records
Compound notes
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