Basic information
- CAS
728036-78-0- Standard SMILES
COc1ccc(F)cc1S(=O)(=O)N1CC(C)CC(C)C1- InChIKey
OUHFXIVFJAQGHS-UHFFFAOYSA-N- Molecular formula
- C14H20FNO3S
- Average molar mass
- 301.38 g/mol
- Monoisotopic mass
- 301.11479284
Names & identifiers
- Preferred name
- 1-[(5-Fluoro-2-methoxyphenyl)sulfonyl]-3,5-dimethylpiperidine
- IUPAC
- 1-(5-fluoro-2-methoxyphenyl)sulfonyl-3,5-dimethylpiperidine
- English name
- 1-[(5-fluoro-2-methoxyphenyl)sulfonyl]-3,5-dimethylpiperidine
- Molecular formula
- C14H20FNO3S
- Molecular weight
- 301.38
Names & synonyms
1-[(5-fluoro-2-methoxyphenyl)sulfonyl]-3,5-dimethylpiperidine728036-78-01-(5-fluoro-2-methoxyphenyl)sulfonyl-3,5-dimethylpiperidineMLS000531735CHEMBL1489811REGID_for_CID_2978550HMS2448K19STK782281AKOS002286417AKOS016331923SMR000136713AP-263/43028329
Show more names
Piperidine, 1-[(5-fluoro-2-methoxyphenyl)sulfonyl]-3,5-dimethyl-
SR-01000297857SR-01000297857-1Z15444049021-(5-fluoro-2-methoxybenzene-1-sulfonyl)-3,5-dimethylpiperidine
Database identifiers
- CAS
728036-78-0- PubChem CID
- 2978550
- ChEMBL
CHEMBL1489811
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 413
Chemistry & industry
Suppliers2 total
OTAVA-BB[email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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