Название: 4-(adamantan-1-ylmethoxy)-3-(2-methoxypyridin-3-yl)benzonitrile
SMILES:
COc1ncccc1-c1cc(C#N)ccc1OCC12CC3CC(CC(C3)C1)C2Molecular Processing
Molecular formula
C24H26N2O2
Molecular weight
374.48
Exact mass
374.1994
XLogP
5.22
TPSA
55.14
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
28
Rings
6
Aromatic rings
2
Saturated rings
4
Aliphatic rings
4
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
107.04
Supplementary Information
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