4-[(5-Fluoro-2-methoxyphenyl)methoxy]-2-methylquinazoline

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Basic information

CAS: 878941-92-5
Standard SMILES: COc1ccc(F)cc1COc1nc(C)nc2ccccc12
InChIKey: WEONLZFWLQLRFZ-UHFFFAOYSA-N
Molecular formula: C17H15FN2O2
Average molar mass: 298.31 g/mol
Monoisotopic mass: 298.11175589

Names & identifiers

Preferred name: 4-[(5-Fluoro-2-methoxyphenyl)methoxy]-2-methylquinazoline
IUPAC: 4-[(5-fluoro-2-methoxyphenyl)methoxy]-2-methylquinazoline

Names & synonyms

MLS001176865CHEMBL14664054-[(5-fluoro-2-methoxyphenyl)methoxy]-2-methylquinazolineDTXSID801326772HMS2902P23AKOS033438511878941-92-5SMR000595171Z15750721

Database identifiers

CAS: 878941-92-5
PubChem CID: 9505600
DTXSID: DTXSID801326772
ChEMBL: CHEMBL1466405

Properties

Computed structural properties

XLogP: 3.8
Topological polar surface area: 44.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 4
Heavy atoms: 22
Formal charge: 0
Complexity: 358

Experimental & physicochemical properties

Solubility28.3 [ug/mL] (The mean of the results at pH 7.4)

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Compound notes

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