Basic information
- Standard SMILES
O=C(NC(CCCc1ccccc1)CCCc1ccccc1)C1CCN(C(=O)C2CCCCN2C[C@@H](O)COc2cccc3ncccc23)CC1- InChIKey
HWXAYXFRSHJJEZ-DWWHTBOVSA-N- Molecular formula
- C43H54N4O4
- Average molar mass
- 690.9 g/mol
- Monoisotopic mass
- 690.41450622
Names & identifiers
- Preferred name
- N-{1-[2-(R)-hydroxy-3-(quinolin-5-yloxy)-propyl]-piperidine-2-carbonyl}-piperidine-4-carboxylic acid [4-phenyl-1-(3-phenyl-propyl)-butyl]-amide
- IUPAC
- N-(1,7-diphenylheptan-4-yl)-1-[1-[(2R)-2-hydroxy-3-quinolin-5-yloxypropyl]piperidine-2-carbonyl]piperidine-4-carboxamide
Names & synonyms
SCHEMBL12598102HWXAYXFRSHJJEZ-DWWHTBOVSA-NN-{1-[2-(R)-hydroxy-3-(quinolin-5-yloxy)-propyl]-piperidine-2-carbonyl}-piperidine-4-carboxylic acid [4-phenyl-1-(3-phenyl-propyl)-butyl]-amide
Database identifiers
- PubChem CID
- 10168893
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 95 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 16
- Heavy atoms
- 51
- Formal charge
- 0
- Complexity
- 999
Related reactions
1 records
Compound notes
Loading…