الاسم: tert-butyl 4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)piperazine-1-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CCN(c2cc(B3OC(C)(C)C(C)(C)O3)ccn2)CC1Molecular Processing
Molecular formula
C20H32BN3O4
Molecular weight
389.31
Exact mass
389.2486
XLogP
2.44
TPSA
64.13
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
28
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.7
Molar refractivity
109.97
Supplementary Information
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