SMILES:
COC(=O)c1c(Cl)cc(NC(=O)OC(C)(C)C)cc1ClMolecular Processing
Molecular formula
C13H15Cl2NO4
Molecular weight
320.17
Exact mass
319.0378
XLogP
4.13
TPSA
64.63
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
77.66
Supplementary Information
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