SMILES:
CCOCCOc1cccc2[nH]c(C(Cl)(Cl)Cl)nc12Molecular Processing
Molecular formula
C12H13Cl3N2O2
Molecular weight
323.61
Exact mass
322.0043
XLogP
3.8
TPSA
47.14
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
77.32
Supplementary Information
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