名称: 2-(5-{[4-(4-{[tert-butyl(dimethyl)silyl]oxy}cyclohexyl)-5-oxo-7-propyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methyl}pyridin-2-yl)benzonitrile
SMILES:
CCCc1c(Cc2ccc(-c3ccccc3C#N)nc2)c(=O)n(C2CCC(O[Si](C)(C)C(C)(C)C)CC2)c2ncnn12Molecular Processing
Molecular formula
C33H42N6O2Si
Molecular weight
582.83
Exact mass
582.3139
XLogP
6.87
TPSA
98.1
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
42
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.485
Molar refractivity
168.01
Supplementary Information
詳細情報を取得中…
11 件の反応に参加→