Название: cyclobutanecarboxylic acid N′-{4-[1-benzyl-4-(3-methoxy-phenyl)-piperidin-4-yl]-benzoyl}-hydrazide
SMILES:
COc1cccc(C2(c3ccc(C(=O)NNC(=O)C4CCC4)cc3)CCN(Cc3ccccc3)CC2)c1Molecular Processing
Molecular formula
C31H35N3O3
Molecular weight
497.64
Exact mass
497.2678
XLogP
4.84
TPSA
70.67
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
37
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.355
Molar refractivity
144.12
Supplementary Information
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