Basic information
- Standard SMILES
COc1ccccc1N(CCN1CCC(C(=O)c2ccc(F)cc2)CC1)C(=O)c1ccc(CNS(C)(=O)=O)cc1- InChIKey
GLMMSSYKAOXHHE-UHFFFAOYSA-N- Molecular formula
- C30H34FN3O5S
- Average molar mass
- 567.7 g/mol
Names & identifiers
- Preferred name
- N-{2-[4-(4-fluorobenzoyl)piperidino]ethyl}-4-(methanesulfonylamino)methyl-N-(2-methoxyphenyl)benzamide
- IUPAC
- N-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-4-(methanesulfonamidomethyl)-N-(2-methoxyphenyl)benzamide
Names & synonyms
SCHEMBL9232009GLMMSSYKAOXHHE-UHFFFAOYSA-NN-{2-[4-(4-fluorobenzoyl)piperidino]ethyl}-4-(methanesulfonylamino)methyl-N-(2-methoxyphenyl)benzamide
Database identifiers
- PubChem CID
- 19689935
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 920
Related reactions
2 records
Compound notes
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