SMILES:
CC(C)(C)CN1CC(CC=O)OC(c2cccc3c2OCCO3)c2cc(Cl)ccc21Molecular Processing
Molecular formula
C24H28ClNO4
Molecular weight
429.94
Exact mass
429.1707
XLogP
5.04
TPSA
48
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
117.95
Supplementary Information
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