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Metamifop

C23H18ClFN2O4CAS 256412-89-2440.86 g/mol

Open in Covalent MOL file
OONClOONF
AmideAryl halideEther

Properties

Molecular formula
C23H18ClFN2O4
Molar mass
440.86 g/mol
Exact mass
440.0939 Da
logP
5.84Crippen estimate
Polar surface area
64.8 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
6

Identifiers

CAS number
256412-89-2
SMILES
CC(Oc1ccc(Oc2nc3ccc(Cl)cc3o2)cc1)C(=O)N(C)c1ccccc1F
InChIKey
ADDQHLREJDZPMT-UHFFFAOYSA-N
InChI
InChI=1S/C23H18ClFN2O4/c1-14(22(28)27(2)20-6-4-3-5-18(20)25)29-16-8-10-17(11-9-16)30-23-26-19-12-7-15(24)13-21(19)31-23/h3-14H,1-2H3

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Names and synonyms

2 names
  • Propanamide, 2-[4-[(6-chloro-2-benzoxazolyl)oxy]phenoxy]-N-(2-fluorophenyl)-N-methyl-
  • 2-[4-[(6-Chloro-2-benzoxazolyl)oxy]phenoxy]-N-(2-fluorophenyl)-N-methylpropanamide

Work with Metamifop

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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