Name: cis-4-[4-(7-[2-(Trimethylsilyl)ethoxy]methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]cyclohexylmethyl thiocyanate
SMILES:
C[Si](C)(C)CCOCn1ccc2c(-c3cnn([C@H]4CC[C@@H](CSC#N)CC4)c3)ncnc21Molecular Processing
Molecular formula
C23H32N6OSSi
Molecular weight
468.7
Exact mass
468.2128
XLogP
5.55
TPSA
81.55
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.565
Molar refractivity
131.92
Supplementary Information
Details werden geladen…
An 16 Reaktionen beteiligt→