SMILES:
CC(C)(C)OC(=O)N1CCCC(COc2ccc(-c3ccc(Cl)cc3)cc2)C1Molecular Processing
Molecular formula
C23H28ClNO3
Molecular weight
401.93
Exact mass
401.1758
XLogP
6.03
TPSA
38.77
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
112.91
Supplementary Information
Details werden geladen…
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