Nom: {4-[3-[3-(4-chloro-benzylamino)-phenyl]-1-(2-trimethylsilanyl-ethoxymethyl)-1H-pyrazolo[3,4-d]pyrimidin-6-ylamino]-cyclohexyl}-carbamic acid tert-butyl ester
SMILES:
CC(C)(C)OC(=O)NC1CCC(Nc2ncc3c(-c4cccc(NCc5ccc(Cl)cc5)c4)nn(COCC[Si](C)(C)C)c3n2)CC1Molecular Processing
Molecular formula
C35H48ClN7O3Si
Molecular weight
678.35
Exact mass
677.3276
XLogP
8.32
TPSA
115.22
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
12
Heavy atoms
47
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.486
Molar refractivity
192.68
Supplementary Information
Récupération des détails…
Impliqué dans 3 réactions→