Name: title compound
SMILES:
Cc1c(-c2ccc(NC(=O)Nc3cc(C(F)(F)F)ccn3)cc2)c2c(N)ncnn2c1CN1CCOCC1Molecular Processing
Molecular formula
C25H25F3N8O2
Molecular weight
526.52
Exact mass
526.2053
XLogP
4.18
TPSA
122.7
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
38
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.28
Molar refractivity
135.55
Supplementary Information
Details werden geladen…
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