O=C(Cc1cccc2[nH]nnc12)c1ccc(Cl)cc1Cl
SMILES: O=C(Cc1cccc2[nH]nnc12)c1ccc(Cl)cc1Cl

Molecular Processing

Molecular formula
C14H9Cl2N3O
Molecular weight
306.15
Exact mass
305.0123
XLogP
3.69
TPSA
58.64
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
78.39

Supplementary Information

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