Basic information
- Standard SMILES
OCC(O)CN1CCN(c2ccc(Cl)nn2)CC1- InChIKey
YHZFHVUVDRJBTP-UHFFFAOYSA-N- Molecular formula
- C11H17ClN4O2
- Average molar mass
- 272.73 g/mol
- Monoisotopic mass
- 272.1040035
Names & identifiers
- Preferred name
- 3-[4-(6-Chloropyridazin-3-yl)piperazin-1-yl]propane-1,2-diol
- IUPAC
- 3-[4-(6-chloropyridazin-3-yl)piperazin-1-yl]propane-1,2-diol
Names & synonyms
SCHEMBL9492546YHZFHVUVDRJBTP-UHFFFAOYSA-N3-[4-(6-Chloropyridazin-3-yl)piperazin-1-yl]propane-1,2-diol
Database identifiers
- PubChem CID
- 20032012
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 72.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 251
Related reactions
2 records
Compound notes
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