Name: boronate
SMILES:
Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3F)cn1)OC(F)(F)O2Molecular Processing
Molecular formula
C19H12F3N3O3
Molecular weight
387.32
Exact mass
387.0831
XLogP
4.16
TPSA
73.34
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.105
Molar refractivity
92.76
Supplementary Information
Details werden geladen…
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