Basic information
- CAS
35451-77-5- Standard SMILES
CCCCN1CCN(Cn2nc(-c3ccccc3)ccc2=O)CC1- InChIKey
HCAXGVADQJIQQL-UHFFFAOYSA-N- Molecular formula
- C19H26N4O
- Average molar mass
- 326.4 g/mol
- Monoisotopic mass
- 326.21066147
Names & identifiers
- Preferred name
- 3(2H)-Pyridazinone, 2-((4-butyl-1-piperazinyl)methyl)-6-phenyl-
- IUPAC
- 2-[(4-butylpiperazin-1-yl)methyl]-6-phenylpyridazin-3-one
Names & synonyms
3(2H)-Pyridazinone, 2-((4-butyl-1-piperazinyl)methyl)-6-phenyl-35451-77-52-((4-Butyl-1-piperazinyl)methyl)-6-phenyl-3(2H)-pyridazinoneDTXSID30188966RefChem:269473DTXCID901114572-[(4-butylpiperazin-1-yl)methyl]-6-phenylpyridazin-3(2h)-one
Database identifiers
- CAS
35451-77-5- PubChem CID
- 215324
- DTXSID
DTXSID30188966- Nikkaji
- J78.861I
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 474
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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