SMILES:
CC(O)CN1N=CCCC1c1ccc(Cl)c(Cl)c1Molecular Processing
Molecular formula
C13H16Cl2N2O
Molecular weight
287.19
Exact mass
286.064
XLogP
3.5
TPSA
35.83
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
75.32
Supplementary Information
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