SMILES:
COC(=O)CCCc1nc(-c2ccc(C)cc2)oc1C(F)(F)FMolecular Processing
Molecular formula
C16H16F3NO3
Molecular weight
327.3
Exact mass
327.1082
XLogP
4.16
TPSA
52.33
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
76.63
Supplementary Information
Details werden geladen…
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