SMILES:
C[C@H]1C[C@H](N)CCN1C(=O)c1cnn(C)c1Cl.O=C(O)C(F)(F)FMolecular Processing
Molecular formula
C13H18ClF3N4O3
Molecular weight
370.76
Exact mass
370.102
XLogP
1.66
TPSA
101.45
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
2
Fraction Csp3
0.615
Molar refractivity
79.62
Supplementary Information
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