NC(=O)c1cccc2c1c1c(OCC(=O)O)cc(-c3ccc(C(F)(F)F)cc3)cc1n2Cc1ccccc1
SMILES: NC(=O)c1cccc2c1c1c(OCC(=O)O)cc(-c3ccc(C(F)(F)F)cc3)cc1n2Cc1ccccc1

Molecular Processing

Molecular formula
C29H21F3N2O4
Molecular weight
518.49
Exact mass
518.1453
XLogP
6.09
TPSA
94.55
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
38
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.103
Molar refractivity
137.07

Supplementary Information

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