Basic information
- Standard SMILES
COc1ccccc1N(CCN1CCC(C(=O)c2ccc(F)cc2)CC1)C(=O)c1ccc([N+](=O)[O-])cc1- InChIKey
IBYGHQMMHAGXAN-UHFFFAOYSA-N- Molecular formula
- C28H28FN3O5
- Average molar mass
- 505.5 g/mol
Names & identifiers
- Preferred name
- 4-Nitro-N-{2-[4-(4-fluorobenzoyl)piperidino]ethyl}-N-(2-methoxyphenyl)benzamide
- IUPAC
- N-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-N-(2-methoxyphenyl)-4-nitrobenzamide
Names & synonyms
SCHEMBL8716646IBYGHQMMHAGXAN-UHFFFAOYSA-N4-Nitro-N-{2-[4-(4-fluorobenzoyl)piperidino]ethyl}-N-(2-methoxyphenyl)benzamide
Database identifiers
- PubChem CID
- 19689913
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 95.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 768
Related reactions
2 records
Compound notes
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