SMILES:
CC(=O)NCC1CCc2c(Cl)ccc(N)c2C1=OMolecular Processing
Molecular formula
C13H15ClN2O2
Molecular weight
266.73
Exact mass
266.0822
XLogP
1.8
TPSA
72.19
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
70.69
Supplementary Information
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