Name: 1-(4-Benzyl-morpholin-2-yl)-1-(3-fluoro-phenyl)-2-(2-methoxy-phenyl)-ethanol
SMILES:
COc1ccccc1CC(O)(c1cccc(F)c1)C1CN(Cc2ccccc2)CCO1Molecular Processing
Molecular formula
C26H28FNO3
Molecular weight
421.51
Exact mass
421.2053
XLogP
4.17
TPSA
41.93
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
118.45
Supplementary Information
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