chempirical

2,6-Dichloro-5-fluoronicotinamide

C6H3Cl2FN2OCAS 113237-20-0209.00 g/mol

Open in Covalent MOL file
NFClClONH2
AmideAryl halide

Properties

Molecular formula
C6H3Cl2FN2O
Molar mass
209.00 g/mol
Exact mass
207.9606 Da
logP
1.63Crippen estimate
Polar surface area
56.0 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
113237-20-0
SMILES
C1=C(C(=NC(=C1F)Cl)Cl)C(=O)N
InChIKey
ZVYNUGSPFZCYEV-UHFFFAOYSA-N
InChI
InChI=1S/C6H3Cl2FN2O/c7-4-2(6(10)12)1-3(9)5(8)11-4/h1H,(H2,10,12)

Weigh it out

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Work with 2,6-Dichloro-5-fluoronicotinamide

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

Similar compounds

2,6-Dichloro-5-fluoronicotinic acid82671-06-561 % similar 3-Chloro-2-fluorobenzamide104326-94-544 % similar 2-Amino-6-fluorobenzamide115643-59-937 % similar 3,5-Difluorobenzamide132980-99-536 % similar 2,4-Dichloro-5-fluoropyrimidine2927-71-135 % similar 2-Chloroisonicotinamide100859-84-534 % similar 2-Chloro-4,5-difluorobenzoic acid110877-64-034 % similar 2'-Chloro-4',5'-difluoroacetophenone121872-94-434 % similar

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

Elsewhere

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