CC1(C)Cc2cccc(C3(O)CCN(Cc4ccccc4)CC3)c2O1
SMILES: CC1(C)Cc2cccc(C3(O)CCN(Cc4ccccc4)CC3)c2O1

Molecular Processing

Molecular formula
C22H27NO2
Molecular weight
337.46
Exact mass
337.2042
XLogP
3.88
TPSA
32.7
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
99.7

Supplementary Information

Details werden geladen…

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