(3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid
Basic information
- CAS
157604-54-1- Standard SMILES
COc1ccc(C(OCCN2CCC[C@@H](C(=O)O)C2)(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1- InChIKey
VDLDUZLDZBVOAS-JOCHJYFZSA-N- Molecular formula
- C30H35NO6
- Average molar mass
- 505.6 g/mol
- Monoisotopic mass
- 505.24643784
Names & identifiers
- Preferred name
- (3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid
- IUPAC
- (3R)-1-[2-[tris(4-methoxyphenyl)methoxy]ethyl]piperidine-3-carboxylic acid
Names & synonyms
CHEMBL419823157604-54-1(R)-1-(2-(Tris(4-methoxyphenyl)methoxy)ethyl)piperidine-3-carboxylic acidNCGC00025217-01Tocris-1561DTXSID201139983BDBM50039248(3R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid(R)-1-{2-[Tris-(4-methoxy-phenyl)-methoxy]-ethyl}-piperidine-3-carboxylic acid3-Piperidinecarboxylic acid, 1-[2-[tris(4-methoxyphenyl)methoxy]ethyl]-, (R)-
Database identifiers
- CAS
157604-54-1- PubChem CID
- 6604883
- DTXSID
DTXSID201139983- ChEMBL
CHEMBL419823- Nikkaji
- J605.693H
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 620
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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