이름: 5-bromo-6-fluoro-3-[(E)-2-(4-fluorophenyl)vinyl]-1-trityl-1H-indazole
SMILES:
Fc1ccc(/C=C/c2nn(C(c3ccccc3)(c3ccccc3)c3ccccc3)c3cc(F)c(Br)cc23)cc1Molecular Processing
Molecular formula
C34H23BrF2N2
Molecular weight
577.47
Exact mass
576.1013
XLogP
9.09
TPSA
17.82
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
39
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.029
Molar refractivity
157.32
Supplementary Information
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