SMILES:
COC(=O)C=Cc1cc(C(F)(F)F)cc2ncn(-c3ccccc3)c12Molecular Processing
Molecular formula
C18H13F3N2O2
Molecular weight
346.31
Exact mass
346.0929
XLogP
4.23
TPSA
44.12
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
87.12
Supplementary Information
Details werden geladen…
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