NC(=O)c1cccc2c1c1c(OCC(=O)O)cccc1n2Cc1cccc(OC(F)(F)F)c1
SMILES: NC(=O)c1cccc2c1c1c(OCC(=O)O)cccc1n2Cc1cccc(OC(F)(F)F)c1

Molecular Processing

Molecular formula
C23H17F3N2O5
Molecular weight
458.39
Exact mass
458.109
XLogP
4.3
TPSA
103.78
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
33
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.13
Molar refractivity
113.32

Supplementary Information

Details werden geladen…

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