SMILES:
O=C(c1ccc(-c2cccc(C(F)(F)F)c2)o1)N1Cc2c([nH]c3ccccc3c2=O)C1c1ccc2c(c1)OCO2Molecular Processing
Molecular formula
C30H19F3N2O5
Molecular weight
544.49
Exact mass
544.1246
XLogP
6.28
TPSA
84.77
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
40
Rings
7
Aromatic rings
5
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
138
Supplementary Information
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