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Basic information
- Standard SMILES
Cl.Cl.OCC(O)CN1CCN(c2ccccn2)CC1- InChIKey
BXHWCXPBIIQWJV-UHFFFAOYSA-N- Molecular formula
- C12H21Cl2N3O2
- Average molar mass
- 310.22 g/mol
- Monoisotopic mass
- 309.1010823
Names & identifiers
- Preferred name
- 3-[4-(Pyridin-2-yl) piperazin-1-yl]propane-1,2-diol dihydrochloride
- IUPAC
- 3-(4-pyridin-2-ylpiperazin-1-yl)propane-1,2-diol;dihydrochloride
Names & synonyms
SCHEMBL9493281BXHWCXPBIIQWJV-UHFFFAOYSA-N3-[4-(pyridin-2-yl) piperazin-1-yl]propane-1,2-diol dihydrochloride
Database identifiers
- PubChem CID
- 20032008
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 59.8 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 220
Related reactions
1 records
Compound notes
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