CCCCCCCCC#Cc1coc2ccc(CN(Cc3ccc(C(F)(F)F)cc3)C(=O)C(=O)OCC)cc12
SMILES: CCCCCCCCC#Cc1coc2ccc(CN(Cc3ccc(C(F)(F)F)cc3)C(=O)C(=O)OCC)cc12

Molecular Processing

Molecular formula
C31H34F3NO4
Molecular weight
541.61
Exact mass
541.244
XLogP
7.65
TPSA
59.75
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
39
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.419
Molar refractivity
143.42

Supplementary Information

Obteniendo detalles…

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