Butafenacil
(2-methyl-1-oxo-1-prop-2-enoxypropan-2-yl) 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzoate
Molecular Identity
Butafenacil
(2-methyl-1-oxo-1-prop-2-enoxypropan-2-yl) 2-chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzoate
PubChem CID: 11826859
Butafenacil is an organofluorine compound that is 1-methyl-6-(trifluoromethyl)pyrimidine-2,4(1H,3H)-dione substituted by a 4-chloro-3-({[2-methyl-1-oxo-1-(prop-2-en-1-yloxy)propan-2-yl]oxy}carbonyl)phenyl group at position 3. It is a herbicide which inhibits the protoporphyrinogen-oxidase enzyme in plant chloroplasts, resulting in rapid knockdown of various broadleaf and grass weeds. It has a role as a herbicide and an EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor. It is a benzoate ester, an organofluorine compound, a diester, an olefinic compound and a member of monochlorobenzenes. It is functionally related to a uracil.
2D Structure
Properties
C20H18ClF3N2O6
Molecular Formula
474.80
Molecular Weight
g/mol
474.0805
Exact Mass
Da
3.5
XLogP
Drug-like (Lipinski: < 5)
93.2
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
9
H-Bond Acceptors
842
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Butafenacil134605-64-4FluobutracilINSPIRECGA 276854DTXSID9034365CGA-2768547Z141CCP2RDTXCID7014365CHEBI:143863WC-97171,1-DIMETHYL-2-OXO-2-(2-PROPENYLOXY)ETHYL 2-CHLORO-5-(3,6-DIHYDRO-3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)-1(2H)-PYRIMIDINYL)BENZOATE1-(ALLYLOXYCARBONYL)-1-METHYLETHYL 2-CHLORO-5-(1,2,3,6-TETRAHYDRO-3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)PYRIMIDIN-1-YL)BENZOATEBenzoic acid, 2-chloro-5-(3,6-dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl)-, 1,1-dimethyl-2-oxo-2-(2-propenyloxy)ethyl ester1-(allyloxycarbonyl)-1-methylethyl 2-chloro-5-[1,2,3,6-tetrahydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzoate
Data from PubChem (NCBI)
This platform is for informational purposes only and does not constitute medical advice. Always consult a qualified healthcare professional.
Drug Network
Trials and conditions connected to Butafenacil
Loading drug network...