Название: 9-amino-9-[4-bromo-1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]nonan-3-one
SMILES:
CCC(=O)CCCCCC(C1=NC(=CN1COCC[Si](C)(C)C)Br)NMolecular Processing
Molecular formula
C18H34BrN3O2Si
Molecular weight
432.48
Exact mass
431.1604
XLogP
4.89
TPSA
70.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
13
Heavy atoms
25
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
109.34
Supplementary Information
InChIKey: LBKCTXVSKKLHQS-UHFFFAOYSA-N
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