SMILES:
CC(C)c1nc2c(c(I)c1[C@@H](O)c1ccc(C(C)(C)C#N)cc1)[C@@H](O[Si](C)(C)C(C)(C)C)CC(C)(C)C2Molecular Processing
Molecular formula
C31H45IN2O2Si
Molecular weight
632.7
Exact mass
632.2295
XLogP
8.73
TPSA
66.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
37
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.613
Molar refractivity
163.31
Supplementary Information
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