SMILES:
CCN(CC)CCCOc1ccc(C(=O)c2c(-c3ccccc3)oc3ccc(Cl)cc23)cc1Molecular Processing
Molecular formula
C28H28ClNO3
Molecular weight
461.99
Exact mass
461.1758
XLogP
7.09
TPSA
42.68
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
33
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
134.43
Supplementary Information
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