5,6-Bis(3,4-dichlorophenyl)-2-(2-hydroxyethyl)-3-oxo-2,3-dihydropyridazine-4-carbonitrile
Basic information
- CAS
75660-46-7- Standard SMILES
N#Cc1c(-c2ccc(Cl)c(Cl)c2)c(-c2ccc(Cl)c(Cl)c2)nn(CCO)c1=O- InChIKey
UDPYJRCFUVCNSZ-UHFFFAOYSA-N- Molecular formula
- C19H11Cl4N3O2
- Average molar mass
- 455.1 g/mol
- Monoisotopic mass
- 452.960537
Names & identifiers
- Preferred name
- 5,6-Bis(3,4-dichlorophenyl)-2-(2-hydroxyethyl)-3-oxo-2,3-dihydropyridazine-4-carbonitrile
- IUPAC
- 5,6-bis(3,4-dichlorophenyl)-2-(2-hydroxyethyl)-3-oxopyridazine-4-carbonitrile
Names & synonyms
75660-46-75,6-bis(3,4-dichlorophenyl)-2-(2-hydroxyethyl)-3-oxo-2,3-dihydropyridazine-4-carbonitrileNSC3624555,6-Bis(3,4-dichlorophenyl)-2-(2-hydroxyethyl)-3-oxo-2,3-dihydro-4-pyridazinecarbonitrile4-Pyridazinecarbonitrile, 5,6-bis(3,4-dichlorophenyl)-2,3-dihydro-2-(2-hydroxethyl)-3-oxo-NSC-362455NSC 362455NWX6GM7VWMCHEMBL31232DTXSID50226571DS-0088655,6-Bis(3,4-dichlorophenyl)-2,3-dihydro-2-(2-hydroxyethyl)-3-oxo-4-pyridazinecarbonitrile
Show more names
5,6-bis(3,4-dichlorophenyl)-2-(2-hydroxyethyl)-3-oxo-pyridazine-4-carbonitrile
Database identifiers
- CAS
75660-46-7- PubChem CID
- 100762
- DTXSID
DTXSID50226571- ChEMBL
CHEMBL31232- UNII
- NWX6GM7VWM
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 732
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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