Basic information
- Standard SMILES
CC(N)=NOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)cc1- InChIKey
PLOKMPKJBVNXHW-ZDUSSCGKSA-N- Molecular formula
- C14H18FN3O4S
- Average molar mass
- 343.38 g/mol
Names & identifiers
- Preferred name
- N'1-[((2S)-1-[(4-fluorophenyl)sulfonyl]-2-piperidylcarbonyl)oxy]ethanimidamide
- IUPAC
- (1-aminoethylideneamino) (2S)-1-(4-fluorophenyl)sulfonylpiperidine-2-carboxylate
Names & synonyms
PLOKMPKJBVNXHW-ZDUSSCGKSA-NN'1-[((2S)-1-[(4-fluorophenyl)sulfonyl]-2-piperidylcarbonyl)oxy]ethanimidamide
Database identifiers
- PubChem CID
- 86759129
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 553
Related reactions
2 records
Compound notes
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