SMILES:
CC(=O)OC(CNC(=N)C(Cl)(Cl)Cl)COc1ccccc1.ClMolecular Processing
Molecular formula
C13H16Cl4N2O3
Molecular weight
390.09
Exact mass
387.9915
XLogP
3.36
TPSA
71.41
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.385
Molar refractivity
90.76
Supplementary Information
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