SMILES:
CC(=NO)c1cc2c(cc1O)C1CC2CN(C(=O)C(F)(F)F)C1Molecular Processing
Molecular formula
C15H15F3N2O3
Molecular weight
328.29
Exact mass
328.1035
XLogP
2.57
TPSA
73.13
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
23
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
74.84
Supplementary Information
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