الاسم: 1-[4-(2,2-dimethylpropyl)-1-trityl-1H-imidazol-2-yl]-2-[4-(1-methyl-1H-pyrazol-4-yl)phenyl]propan-2-ol
SMILES:
Cn1cc(-c2ccc(C(C)(O)Cc3nc(CC(C)(C)C)cn3C(c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cn1Molecular Processing
Molecular formula
C40H42N4O
Molecular weight
594.8
Exact mass
594.3359
XLogP
8.16
TPSA
55.87
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
9
Heavy atoms
45
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
181.91
Supplementary Information
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