Basic information
- Standard SMILES
CCCCc1n[nH]c(=O)cc1-c1ccc(OC2CCCCC2)cc1- InChIKey
ALCGOWVXXBHUIQ-UHFFFAOYSA-N- Molecular formula
- C20H26N2O2
- Average molar mass
- 326.4 g/mol
- Monoisotopic mass
- 326.19942808
Names & identifiers
- Preferred name
- 6-butyl-5-(4-cyclohexyloxy-phenyl)-2H-pyridazin-3-one
- IUPAC
- 3-butyl-4-(4-cyclohexyloxyphenyl)-1H-pyridazin-6-one
Names & synonyms
SCHEMBL2353714ALCGOWVXXBHUIQ-UHFFFAOYSA-N6-butyl-5-(4-cyclohexyloxy-phenyl)-2H-pyridazin-3-one
Database identifiers
- PubChem CID
- 67375285
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 484
Related reactions
7 records
Compound notes
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