SMILES:
CC1(N)CN(C(=O)Nc2ccc(C(F)(F)F)cc2)N=C1c1ccc(Cl)cc1Molecular Processing
Molecular formula
C18H16ClF3N4O
Molecular weight
396.8
Exact mass
396.0965
XLogP
4.33
TPSA
70.72
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
97.75
Supplementary Information
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