O=c1[nH]ncc(Cl)c1Cl
SMILES: O=c1[nH]ncc(Cl)c1Cl

Molecular Processing

Molecular formula
C4H2Cl2N2O
Molecular weight
164.98
Exact mass
163.9544
XLogP
1.08
TPSA
45.75
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
34.88

Supplementary Information

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