SMILES:
O=C(NC1CCCCC1)C1=C(c2ccccc2)c2ccc(OCCN3CCOCC3)cc2C1=OMolecular Processing
Molecular formula
C28H32N2O4
Molecular weight
460.57
Exact mass
460.2362
XLogP
3.84
TPSA
67.87
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
34
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
131.01
Supplementary Information
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