Nombre: ( 3 )
SMILES:
CC(C)(C)OC(=O)Nc1ccc2c(c1)OC(C)(C)C(C#N)=C2c1ccc(F)cc1Molecular Processing
Molecular formula
C23H23FN2O3
Molecular weight
394.45
Exact mass
394.1693
XLogP
5.67
TPSA
71.35
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
109.04
Supplementary Information
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