SMILES:
O=C1C(CO)OC(c2ccccc2Cl)c2cc(Cl)ccc2N1Cc1ccccc1Molecular Processing
Molecular formula
C23H19Cl2NO3
Molecular weight
428.32
Exact mass
427.0742
XLogP
5.01
TPSA
49.77
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.174
Molar refractivity
114.34
Supplementary Information
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