SMILES:
CC(=O)N(c1ccccc1C)c1ncc(Cl)c(C#N)c1ClMolecular Processing
Molecular formula
C15H11Cl2N3O
Molecular weight
320.18
Exact mass
319.0279
XLogP
4.25
TPSA
56.99
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
21
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
0.133
Molar refractivity
82.97
Supplementary Information
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