Piperidine, 1-((4,5-diphenyl-2-oxazolyl)methyl)-, monohydrochloride
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Basic information
- CAS
33161-85-2- Standard SMILES
Cl.c1ccc(-c2nc(CN3CCCCC3)oc2-c2ccccc2)cc1- InChIKey
DXSVJQUADGSBPV-UHFFFAOYSA-N- Molecular formula
- C21H23ClN2O
- Average molar mass
- 354.9 g/mol
- Monoisotopic mass
- 354.1498911
Names & identifiers
- Preferred name
- Piperidine, 1-((4,5-diphenyl-2-oxazolyl)methyl)-, monohydrochloride
- IUPAC
- 4,5-diphenyl-2-(piperidin-1-ylmethyl)-1,3-oxazole;hydrochloride
Names & synonyms
Piperidine, 1-((4,5-diphenyl-2-oxazolyl)methyl)-, monohydrochloride33161-85-21-((4,5-Diphenyl-2-oxazolyl)methyl)piperidine monohydrochlorideDTXSID80186816RefChem:372848DTXCID20109307SCHEMBL117182991-[(4,5-Diphenyl-1,3-oxazol-2-yl)methyl]piperidine--hydrogen chloride (1/1)
Database identifiers
- CAS
33161-85-2- PubChem CID
- 214428
- DTXSID
DTXSID80186816
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 370
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Compound notes
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