SMILES:
CC1(C)C(=O)NCCN1C(=O)c1oc(C(F)(F)F)cc1NMolecular Processing
Molecular formula
C12H14F3N3O3
Molecular weight
305.26
Exact mass
305.0987
XLogP
1.23
TPSA
88.57
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
66.25
Supplementary Information
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