الاسم: [2-methyl-1-(7-{5-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-1H-imidazol-2-yl}-5-oxa-6-azaspiro[3.4]octane-6-carbonyl)-propyl]-carbamic acid methyl ester
SMILES:
COC(=O)NC(C(=O)N1OC2(CCC2)CC1c1ncc(-c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)[nH]1)C(C)CMolecular Processing
Molecular formula
C28H39BN4O6
Molecular weight
538.45
Exact mass
538.2963
XLogP
3.88
TPSA
115.01
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
39
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.607
Molar refractivity
145.78
Supplementary Information
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