SMILES:
O=C(CCl)N1CCN(c2ccc(Cl)cc2)CC1Molecular Processing
Molecular formula
C12H14Cl2N2O
Molecular weight
273.16
Exact mass
272.0483
XLogP
2.23
TPSA
23.55
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
70.97
Supplementary Information
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