2-[(2S)-1-[(4-fluorophenyl)sulfonyl]-2-piperidyl]-5-methyl-1,3,4-thiadiazole
Basic information
- Standard SMILES
Cc1nnc([C@@H]2CCCCN2S(=O)(=O)c2ccc(F)cc2)s1- InChIKey
AAGGWEXWIPLPDT-ZDUSSCGKSA-N- Molecular formula
- C14H16FN3O2S2
- Average molar mass
- 341.4 g/mol
Names & identifiers
- Preferred name
- 2-[(2S)-1-[(4-fluorophenyl)sulfonyl]-2-piperidyl]-5-methyl-1,3,4-thiadiazole
- IUPAC
- 2-[(2S)-1-(4-fluorophenyl)sulfonylpiperidin-2-yl]-5-methyl-1,3,4-thiadiazole
Names & synonyms
SCHEMBL6963311AAGGWEXWIPLPDT-ZDUSSCGKSA-N2-[(2S)-1-[(4-fluorophenyl)sulfonyl]-2-piperidyl]-5-methyl-1,3,4-thiadiazole
Database identifiers
- PubChem CID
- 9862833
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 99.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 477
Related reactions
1 records
Compound notes
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