Basic information
- Standard SMILES
COc1cccc(OC)c1C1CCN(C(=O)c2cn(Cc3ccncc3)c3cc(Cl)ccc23)CC1- InChIKey
IZTMBSIYZYEFLU-UHFFFAOYSA-N- Molecular formula
- C28H28ClN3O3
- Average molar mass
- 490 g/mol
Names & identifiers
- Preferred name
- (6-Chloro-1-pyridin-4-ylmethyl-1H-indol-3-yl)-[4-(2,6-dimethoxy-phenyl)-piperidin-1-yl]-methanone
- IUPAC
- [6-chloro-1-(pyridin-4-ylmethyl)indol-3-yl]-[4-(2,6-dimethoxyphenyl)piperidin-1-yl]methanone
Names & synonyms
SCHEMBL614456IZTMBSIYZYEFLU-UHFFFAOYSA-N(6-Chloro-1-pyridin-4-ylmethyl-1H-indol-3-yl)-[4-(2,6-dim ethoxy-phenyl)-piperidin-1-yl]-methanone(6-Chloro-1-pyridin-4-ylmethyl-1H-indol-3-yl)-[4-(2,6-dimethoxy-phenyl)-piperidin-1-yl]-methanone
Database identifiers
- PubChem CID
- 16062190
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 56.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 685
Related reactions
2 records
Compound notes
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