1-{4-[(4-Methylpiperidin-1-yl)sulfonyl]phenyl}ethan-1-one
Basic information
- CAS
333787-88-5- Standard SMILES
CC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)cc1- InChIKey
GLTBDTPRRVISBC-UHFFFAOYSA-N- Molecular formula
- C14H19NO3S
- Average molar mass
- 281.37 g/mol
- Monoisotopic mass
- 281.10856464
Names & identifiers
- Preferred name
- 1-{4-[(4-Methylpiperidin-1-yl)sulfonyl]phenyl}ethan-1-one
- IUPAC
- 1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]ethanone
Names & synonyms
333787-88-51-{4-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}ethan-1-one1-{4-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}ethanone1-{4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl}ethanone1-[4-[(4-Methyl-1-piperidinyl)sulfonyl]phenyl]ethanoneBAS 029927951-(4-[(4-METHYLPIPERIDIN-1-YL)SULFONYL]PHENYL)ETHANONE1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]ethanoneSCHEMBL5243271DTXSID201210238INA78788MFCD02573099
Show more names
AKOS000118636NS-04634EN300-08246G25818AG-690/408965431-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]ethanoneZ455421451-[4-(4-Methylpiperidine-1-sulfonyl)phenyl]ethan-1-one
Database identifiers
- CAS
333787-88-5- PubChem CID
- 787667
- DTXSID
DTXSID201210238
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 410
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…