Name: 1-(3-(6-tert-butyl-8-fluoro-1-oxophthalazin-2(1H)-yl)-2-formylphenyl)-1H-indole-3 carbonitrile
SMILES:
CC(C)(C)c1cc(F)c2c(=O)n(-c3cccc(-n4cc(C#N)c5ccccc54)c3C=O)ncc2c1Molecular Processing
Molecular formula
C28H21FN4O2
Molecular weight
464.5
Exact mass
464.1649
XLogP
5.45
TPSA
80.68
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
35
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
132.93
Supplementary Information
Details werden geladen…
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