SMILES:
O=C(Nc1cc(Cl)cc2c1[nH]c1cncc(NC(=O)C(F)(F)F)c12)c1cccnc1Molecular Processing
Molecular formula
C19H11ClF3N5O2
Molecular weight
433.78
Exact mass
433.0553
XLogP
4.52
TPSA
99.77
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.053
Molar refractivity
105.48
Supplementary Information
Details werden geladen…
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