chempirical

Vu 0357121

C17H17F2NO2CAS 433967-28-3305.32 g/mol

Open in Covalent MOL file
OOHNFF
AmideAryl halideEther

Properties

Molecular formula
C17H17F2NO2
Molar mass
305.32 g/mol
Exact mass
305.1227 Da
logP
4.40Crippen estimate
Polar surface area
38.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
6

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
433967-28-3
SMILES
CCCCOC1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)F)F
InChIKey
AHCYOTLTLQTPSU-UHFFFAOYSA-N
InChI
InChI=1S/C17H17F2NO2/c1-2-3-10-22-14-7-4-12(5-8-14)17(21)20-16-9-6-13(18)11-15(16)19/h4-9,11H,2-3,10H2,1H3,(H,20,21)

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Work with Vu 0357121

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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