CC1(CCN(C1)C2=CC(=CC(=C2)C3=CN=C4C(=N3)C(=CN4COCC[Si](C)(C)C)C(=O)C(C)(C)C)OCOC)C
Название: 1-[2-[3-(3,3-dimethylpyrrolidin-1-yl)-5-(methoxymethoxy)phenyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]-2,2-dimethylpropan-1-one
SMILES: CC1(CCN(C1)C2=CC(=CC(=C2)C3=CN=C4C(=N3)C(=CN4COCC[Si](C)(C)C)C(=O)C(C)(C)C)OCOC)C

Molecular Processing

Molecular formula
C31H46N4O4Si
Molecular weight
566.82
Exact mass
566.3288
XLogP
6.86
TPSA
78.71
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
40
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
0.581
Molar refractivity
163.97

Supplementary Information

InChIKey: VTGRAVAGNSIBJZ-UHFFFAOYSA-N
Синонимы
SCHEMBL2272727VTGRAVAGNSIBJZ-UHFFFAOYSA-N1-[2-[3-(3,3-dimethyl-pyrrolidin-1-yl)-5-methoxymethoxy-phenyl]-5-(2-trimethylsilanyl-ethoxymethyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]-2,2-dimethyl-propan-1-one
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