3(2H)-Pyridazinone, 4,5-dihydro-6-(4-propoxyphenyl)-
Basic information
- CAS
39496-54-3- Standard SMILES
CCCOc1ccc(C2=NNC(=O)CC2)cc1- InChIKey
JECPTYOLILQNAT-UHFFFAOYSA-N- Molecular formula
- C13H16N2O2
- Average molar mass
- 232.28 g/mol
- Monoisotopic mass
- 232.12117776
Names & identifiers
- Preferred name
- 3(2H)-Pyridazinone, 4,5-dihydro-6-(4-propoxyphenyl)-
- IUPAC
- 3-(4-propoxyphenyl)-4,5-dihydro-1H-pyridazin-6-one
Names & synonyms
39496-54-34,5-Dihydro-6-(4-propoxyphenyl)-3(2H)-pyridazinone3(2H)-Pyridazinone, 4,5-dihydro-6-(4-propoxyphenyl)-6-(p-Propoxyphenyl)-4,5-dihydro-3(2H)-pyridazinoneDTXSID80192634RefChem:269541DTXCID201151256-(4-propoxyphenyl)-4,5-dihydropyridazin-3(2H)-oneMLS0005871593-(4-propoxyphenyl)-4,5-dihydro-1H-pyridazin-6-oneCBMicro_014635Cambridge id 5229226
Show more names
CHEMBL1489123SCHEMBL10970095HMS2618H06SMSF0004950STL036480AKOS005647288CB12690NCGC00246252-01
Database identifiers
- CAS
39496-54-3- PubChem CID
- 217732
- DTXSID
DTXSID80192634- ChEMBL
CHEMBL1489123
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 294
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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