Compound: Famoxadone
SMILES: O=C1OC(c2ccc(Oc3ccccc3)cc2)(C)C(N1Nc4ccccc4)=O
InChIKey: PCCSBWNGDMYFCW-UHFFFAOYSA-N
Synonyms: Famoxadone, 131807-57-3, Famoxate, Famoxadon, 3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione, DPX-JE 874, 2,4-Oxazolidinedione, 5-methyl-5-(4-phenoxyphenyl)-3-(phenylamino)-, V1C07OR6II, DPX-JE874, DTXSID8034588, 5-METHYL-5-(4-PHENOXYPHENYL)-3-(PHENYLAMINO)-2,4-OXAZOLIDINEDIONE, DTXCID6014588, RefChem:597150, CHEBI:59340, 603-520-1, DPX-JE 874;Famoxate, MFCD03427409, 2,4-oxazolidinedione, 5-methyl-5-(4-phenoxyphenyl)-3- (phenylamino)-, 5-methyl-5-(4-phenoxyphenyl)-3-(phenylamino)-1,3-oxazolidine-2,4-dione, Famoxadone [ISO:BSI], HSDB 7266, UNII-V1C07OR6II, DPX JE874, Famoxate solution, 3-Anilino-5-methyl-5-(4-phenoxyphenyl)oxazolidine-2,4-dione, Famoxadone (Standard), Famoxadone 10 microg/mL in Cyclohexane, FAMOXADONE [MI], FAMOXATE [HSDB], FAMOXADONE [ISO], 2,4-Oxazolidinedione,5-methyl-5-(4-phenoxyphenyl)-3-(phenylamino)-, SCHEMBL63351, orb1693963, CHEMBL1812200, CHEBI:83250, HY-B2008R, HFA58412, HNA06145, HY-B2008, MSK21094, Tox21_301144, AKOS015917628, FF74632, NCGC00168306-01, NCGC00168306-02, NCGC00168306-03, NCGC00255042-01, AS-35178, DB-042062, CAS-131807-57-3, CS-0014109, F1206, NS00000488, Q412776, 5-Methyl-5-(4-phenoxyphenyl)-3-phenylamino-2,4-oxazolidinedione
Theoretical properties:
molecular_formula: C22H18N2O4
molecular_weight: 374.4 g/mol
exact_mass: 374.12665706 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 5
rotatable_bond_count: 5
heavy_atom_count: 28
topological_polar_surface_area: 67.9 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Pale cream powder
color: Pale cream powder
melting_point: 140.3-141.8 °C
density: 1.31 g/cu cm at 22 °C
solubility: In water, 143 ug/L at pH 2; 191 ug/L at pH 3; 243 ug/L at pH 5; 111 ug/L at pH 7; 38 ug/L at pH 9
vapor_pressure: 4.80X10-9 mm Hg at 20 °C
Descriptions:
pubchem: 5-methyl-5-(4-phenoxyphenyl)-3-(phenylamino)-1,3-oxazolidine-2,4-dione is a member of the class of oxazolidinones that is 1,3-oxazolidine-2,4-dione in which the hydrogen attached to the nitrogen is substituted by a phenylamino group and the hydrogens at position 5 are substituted by methyl and 4-phenoxyphenyl groups. It is a carbohydrazide, an aromatic ether and an oxazolidinone.
chebi: A member of the class of oxazolidinones that is 1,3-oxazolidine-2,4-dione in which the hydrogen attached to the nitrogen is substituted by a phenylamino group and the hydrogens at position 5 are substituted by methyl and 4-phenoxyphenyl groups.
chembl: Unnamed Compound is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Famoxadone is a fungicide to protect agricultural products against various fungal diseases on fruiting vegetables, tomatoes, potatoes, curcurbits, lettuce and grapes. It is used in combination with cymoxanil. Famoxadone is a QoI, albeit with a chemistry different from most QoIs. (It is an oxazolidine-dione while most are strobilurins.) It is commonly used against Plasmopara viticola, Alternaria solani, Phytophthora infestans, and Septoria nodorum.