名称: Biaryl amine
SMILES:
CCOc1ccc(-c2ccc(C)nc2)cc1CNC1CCC(N(C)C(=O)OC(C)(C)C)CC1Molecular Processing
Molecular formula
C27H39N3O3
Molecular weight
453.63
Exact mass
453.2991
XLogP
5.72
TPSA
63.69
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
33
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
132.46
Supplementary Information
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