Basic information
- CAS
10360-09-5- Standard SMILES
O=C(OC1CC2CCC(C1)[N+]21CCCC1)C(O)(c1ccccc1)c1ccccc1- InChIKey
OYYDSUSKLWTMMQ-UHFFFAOYSA-N- Molecular formula
- C25H30NO3+
- Average molar mass
- 392.5 g/mol
- Monoisotopic mass
- 392.22256882
Names & identifiers
- Preferred name
- Ceris
- IUPAC
- spiro[8-azoniabicyclo[3.2.1]octane-8,1'-azolidin-1-ium]-3-yl 2-hydroxy-2,2-diphenylacetate
Names & synonyms
Trosec10360-09-5CerisSCHEMBL724191GTPL7480DTXSID001337915NCGC00389420-01NS00010513AB01563027_01L001322Q5133963-[(2-hydroxy-2,2-diphenylacetyl)oxy]-8$l^{5}-azaspiro[bicyclo[3.2.1]octane-8,1'-pyrrolidin]-8-ylium
Show more names
3-[(2-Hydroxy-2,2-diphenylacetyl)oxy]spiro[8-azoniabicyclo[3.2.1]octane-8,1a(2)-pyrrolidinium]spiro[8-azoniabicyclo[3.2.1]octane-8,1'-azolidin-1-ium]-3-yl 2-hydroxy-2,2-di(phenyl)acetate
Database identifiers
- CAS
10360-09-5、47608-32-2- PubChem CID
- 5596
- DTXSID
DTXSID001337915
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 1
- Complexity
- 553
Experimental & physicochemical properties
DrugsPharmaceuticals
Solubility6.68e-05 g/L
Physical DescriptionSolid
Chemistry & industry
Pharmacology
Cellular LocationsMembrane
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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