Basic information
- Standard SMILES
Cl.N#Cc1nn(-c2ccc(Cl)c(Cl)c2)c(=O)cc1OC1CCNCC1- InChIKey
QNKIUAHZUYPDRA-UHFFFAOYSA-N- Molecular formula
- C16H15Cl3N4O2
- Average molar mass
- 401.7 g/mol
Names & identifiers
- Preferred name
- 1-(3,4-dichlorophenyl)-6-oxo-4-(piperidin-4-yloxy)-1,6-dihydropyridazine-3-carbonitrile HCl
- IUPAC
- 1-(3,4-dichlorophenyl)-6-oxo-4-piperidin-4-yloxypyridazine-3-carbonitrile;hydrochloride
Names & synonyms
SCHEMBL2544811QNKIUAHZUYPDRA-UHFFFAOYSA-N1-(3,4-dichlorophenyl)-6-oxo-4-(piperidin-4-yloxy)-1,6-dihydropyridazine-3-carbonitrile HCl
Database identifiers
- PubChem CID
- 67446536
Properties
Computed structural properties
- Topological polar surface area
- 77.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 606
Related reactions
3 records
Compound notes
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