Structure Info
- Chemspace ID
- CSCS00085377815 (Synthesis)
- IUPAC Name
- 3-chloro-4-{[3-(methoxymethyl)piperidin-1-yl]sulfonyl}benzoic acid
- Mol formula
- C14H18ClNO5S
- Mol weight
- 348 Da
- Catalog Number(s)
- CSC085377815, CSCR00156329250, Z2476575758, s_271082____11679312____8788532
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.75
- Heavy atoms count
- 22
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 84
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS00085377815
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