(1-Propionylpiperidin-4-yl)methyl methanesulfonate - CAS 1357353-59-3
Catalog: |
BB059954 |
Product Name: |
(1-Propionylpiperidin-4-yl)methyl methanesulfonate |
CAS: |
1357353-59-3 |
Synonyms: |
1-[4-[[(Methylsulfonyl)oxy]methyl]-1-piperidinyl]-1-propanone |
IUPAC Name: | (1-propanoylpiperidin-4-yl)methyl methanesulfonate |
Description: | (1-Propionylpiperidin-4-yl)methyl methanesulfonate is useful for preparing 5- HT4 receptor agonists. |
Molecular Weight: | 249.33 |
Molecular Formula: | C10H19NO4S |
Canonical SMILES: | CCC(=O)N1CCC(CC1)COS(=O)(=O)C |
InChI: | InChI=1S/C10H19NO4S/c1-3-10(12)11-6-4-9(5-7-11)8-15-16(2,13)14/h9H,3-8H2,1-2H3 |
InChI Key: | KGJFVQWLJUNOFV-UHFFFAOYSA-N |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Colourless to Pale Yellow Oil |
Storage: | Refrigerator, under inert atmosphere |
References: | Park, J. S., et al. Eur. J. Med. Chem., 109, 75 (2016). |
Complexity: | 325 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 249.10347926 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 249.10347926 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 72.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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