SMILES:
CC(=O)Nc1ccc(B2OC(C)(C)C(C)(C)O2)cn1Molecular Processing
Molecular formula
C13H19BN2O3
Molecular weight
262.12
Exact mass
262.1489
XLogP
1.34
TPSA
60.45
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
74.26
Supplementary Information
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