Name: product
SMILES:
CCOC(=O)c1c(Cl)c2cc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)ccc2n1CMolecular Processing
Molecular formula
C26H20ClF3N2O3
Molecular weight
500.9
Exact mass
500.1115
XLogP
6.95
TPSA
60.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
128.72
Supplementary Information
Details werden geladen…
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