Name: product
SMILES:
CCOC(=O)C(Oc1c(Cl)cc(Cn2c(=O)n(C(=O)OCC)c3ccccc32)cc1Cl)c1ccc2c(c1)OCO2Molecular Processing
Molecular formula
C28H24Cl2N2O8
Molecular weight
587.41
Exact mass
586.091
XLogP
5.57
TPSA
107.22
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
40
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
146.75
Supplementary Information
Details werden geladen…
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