SMILES:
CCNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1Molecular Processing
Molecular formula
C16H14Cl2N4O
Molecular weight
349.22
Exact mass
348.0545
XLogP
3.73
TPSA
59.81
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
94.4
Supplementary Information
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