6-Phenyl-5-(piperazin-1-yl)pyridazin-3(2H)-one
Completing data — refresh the page later to see the latest
Basic information
- CAS
132814-16-5- Standard SMILES
O=c1cc(N2CCNCC2)c(-c2ccccc2)n[nH]1- InChIKey
BTLOOVKBRJZVLB-UHFFFAOYSA-N- Molecular formula
- C14H16N4O
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.13241115
Names & identifiers
- Preferred name
- 6-Phenyl-5-(piperazin-1-yl)pyridazin-3(2H)-one
- IUPAC
- 3-phenyl-4-piperazin-1-yl-1H-pyridazin-6-one
- English name
- 6-PHENYL-5-PIPERAZINO-3(2H)-PYRIDAZINONE
- Molecular formula
- C14H16N4O
- Molecular weight
- 256.3
Names & synonyms
132814-16-56-Phenyl-5-(piperazin-1-yl)pyridazin-3(2H)-one6-Phenyl-5-piperazino-3(2H)-pyridazinone3-phenyl-4-piperazin-1-yl-1H-pyridazin-6-oneMFCD025710976-phenyl-5-(piperazin-1-yl)-2,3-dihydropyridazin-3-one6-Phenyl-5-(piperazin-1-yl)pyridazin-3-olSCHEMBL3556833SCHEMBL13116659DTXSID90377632BTLOOVKBRJZVLB-UHFFFAOYSA-NSBB101746
Show more names
6-Phenyl-5-piperazin-1-yl-2H-pyridazin-3-one3(2H)-Pyridazinone, 6-phenyl-5-(1-piperazinyl)-2,3-Dihydro-3-oxo-6-phenyl-5-(piperazin-1-yl)pyridazine, 1-(1,6-Dihydro-6-oxo-3-phenylpyridazin-4-yl)piperazine
AKOS00506950411P-412SDB-369372CS-03185966-phenyl-5-piperazinyl-2-hydropyridazin-3-one6-Phenyl-5-(1-piperazinyl)-3(2H)-pyridazinone
Database identifiers
- CAS
132814-16-5- PubChem CID
- 2767916
- DTXSID
DTXSID90377632- Nikkaji
- J1.048.664E
Properties
Computed structural propertiesFilling in
- XLogP
- 0.9
- Topological polar surface area
- 56.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 404
Physicochemical properties
- Melting point
- 268 · 268-272°C
- Density
- 1.31 · 1.31±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 10.79 · 10.79±0.60(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 280 · P280
- Hazard Codes
- Xi,Xn
- Risk Statements
- 22 · 22
- HazardClass
- IRRITANT
- HS Code
- 2933599590 · 2933599590
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933599590
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn
- hazard_class
- IRRITANT
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P280
Related reactions
3 records
Compound notes
Loading…