Nombre: compound 1
SMILES:
O=C(Cc1ccccc1)c1c[nH]c(C(=O)C(Cl)(Cl)Cl)c1Molecular Processing
Molecular formula
C14H10Cl3NO2
Molecular weight
330.6
Exact mass
328.9777
XLogP
3.99
TPSA
49.93
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
79.89
Supplementary Information
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