Piperidine, 1-(2-(3,4,5-trimethoxyphenyl)sulfonylethyl)-
Basic information
- CAS
57554-04-8- Standard SMILES
COc1cc(S(=O)(=O)CCN2CCCCC2)cc(OC)c1OC- InChIKey
BYJLFUFCSNYZLF-UHFFFAOYSA-N- Molecular formula
- C16H25NO5S
- Average molar mass
- 343.4 g/mol
- Monoisotopic mass
- 343.14534407
Names & identifiers
- Preferred name
- Piperidine, 1-(2-(3,4,5-trimethoxyphenyl)sulfonylethyl)-
- IUPAC
- 1-[2-(3,4,5-trimethoxyphenyl)sulfonylethyl]piperidine
- English name
- Piperidine, 1-(2-(3,4,5-trimethoxyphenyl)sulfonylethyl)-
- Molecular formula
- C16H25NO5S
- Molecular weight
- 343.44
Names & synonyms
Piperidine, 1-(2-(3,4,5-trimethoxyphenyl)sulfonylethyl)-57554-04-8BRN 12634321-(2-(3,4,5-Trimethoxyphenyl)sulfonylethyl)piperidineDTXSID00206181DB-3272521-[2-(3,4,5-Trimethoxybenzene-1-sulfonyl)ethyl]piperidine1-[2-(3,4,5-Trimethoxyphenyl)sulfonylethyl]piperidine1-[2-[(3,4,5-Trimethoxyphenyl)sulfonyl]ethyl]piperidine
Database identifiers
- CAS
57554-04-8- PubChem CID
- 93709
- DTXSID
DTXSID00206181- Nikkaji
- J83.608G
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 73.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 430
Experimental & physicochemical properties
LogP1.6
Physicochemical properties
- EWG's Food Scores
- 1 · 1
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Related reactions
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Compound notes
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