2-{[4-(2,6-Dichlorophenyl)piperidin-1-yl]methyl}-1H-indole
Basic information
- CAS
827016-63-7- Standard SMILES
Clc1cccc(Cl)c1C1CCN(Cc2cc3ccccc3[nH]2)CC1- InChIKey
COYVRVQBPILDCP-UHFFFAOYSA-N- Molecular formula
- C20H20Cl2N2
- Average molar mass
- 359.3 g/mol
- Monoisotopic mass
- 358.100354
Names & identifiers
- Preferred name
- 2-{[4-(2,6-Dichlorophenyl)piperidin-1-yl]methyl}-1H-indole
- IUPAC
- 2-[[4-(2,6-dichlorophenyl)piperidin-1-yl]methyl]-1H-indole
Names & synonyms
827016-63-7SCHEMBL5427585DTXSID30740503COYVRVQBPILDCP-UHFFFAOYSA-N2-{[4-(2,6-Dichlorophenyl)piperidin-1-yl]methyl}-1H-indole2-[4-(2,6-dichloro-phenyl)-piperidin-1-ylmethyl]-1H-indole
Database identifiers
- CAS
827016-63-7- PubChem CID
- 69435397
- DTXSID
DTXSID30740503
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 19 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 400
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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