이름: N,N-dibenzyl-2-(1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl)ethanamine
SMILES:
Cc1cc(N2CCC(CCN(Cc3ccccc3)Cc3ccccc3)CC2)nc(C)n1Molecular Processing
Molecular formula
C27H34N4
Molecular weight
414.6
Exact mass
414.2783
XLogP
5.4
TPSA
32.26
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.407
Molar refractivity
128.06
Supplementary Information
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