N'-(4,6-dimethylpyrimidin-2-yl)-2-hydroxybenzohydrazide
Basic information
- CAS
333779-37-6- Standard SMILES
Cc1cc(C)nc(NNC(=O)c2ccccc2O)n1- InChIKey
CXZWQMLPAVCXGA-UHFFFAOYSA-N- Molecular formula
- C13H14N4O2
- Average molar mass
- 258.28 g/mol
- Monoisotopic mass
- 258.1116757
Names & identifiers
- Preferred name
- N'-(4,6-dimethylpyrimidin-2-yl)-2-hydroxybenzohydrazide
- IUPAC
- N'-(4,6-dimethylpyrimidin-2-yl)-2-hydroxybenzohydrazide
Names & synonyms
N'-(4,6-dimethylpyrimidin-2-yl)-2-hydroxybenzohydrazideBAS 01037680MLS000714624CHEMBL1589303DTXSID201333440HMS2693C09AKOS000601777333779-37-6SMR000274603SR-01000316778SR-01000316778-1Z223680196
Database identifiers
- CAS
333779-37-6- PubChem CID
- 780275
- DTXSID
DTXSID201333440- ChEMBL
CHEMBL1589303
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 303
Experimental & physicochemical properties
Solubility34 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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