Name: 5-{4-methoxy-2-[4-(2-piperidin-1-ylethoxy)phenylamino]phenyl}indan-1-ol
SMILES:
COc1ccc(-c2ccc3c(c2)CCC3O)c(Nc2ccc(OCCN3CCCCC3)cc2)c1Molecular Processing
Molecular formula
C29H34N2O3
Molecular weight
458.6
Exact mass
458.2569
XLogP
5.95
TPSA
53.96
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
34
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.379
Molar refractivity
137.22
Supplementary Information
Details werden geladen…
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