1-Piperazineethanol, 4-((5-phenyl-2-oxazolyl)methyl)-, dihydrochloride
Basic information
- CAS
64639-96-9- Standard SMILES
Cl.Cl.OCCN1CCN(Cc2ncc(-c3ccccc3)o2)CC1- InChIKey
FNGPAKSLULAQMV-UHFFFAOYSA-N- Molecular formula
- C16H23Cl2N3O2
- Average molar mass
- 360.3 g/mol
- Monoisotopic mass
- 359.1167324
Names & identifiers
- Preferred name
- 1-Piperazineethanol, 4-((5-phenyl-2-oxazolyl)methyl)-, dihydrochloride
- IUPAC
- 2-[4-[(5-phenyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]ethanol;dihydrochloride
Names & synonyms
4-((5-Phenyl-2-oxazolyl)methyl)-1-piperazineethanol dihydrochloride64639-96-91-Piperazineethanol, 4-((5-phenyl-2-oxazolyl)methyl)-, dihydrochloride2-(4-(2-Hydroxyethyl)-1-piperazinylmethyl)-5-phenyloxazole dihydrochlorideRefChem:233688DTXSID209832452-{4-[(5-Phenyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl}ethan-1-ol--hydrogen chloride (1/2)
Database identifiers
- CAS
64639-96-9- PubChem CID
- 3049293
- DTXSID
DTXSID20983245
Properties
Computed structural properties
- Topological polar surface area
- 52.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 302
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Compound notes
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