SMILES:
CC1CCN(CCOc2ccc(N)cc2Cl)CC1Molecular Processing
Molecular formula
C14H21ClN2O
Molecular weight
268.79
Exact mass
268.1342
XLogP
3.03
TPSA
38.49
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
76.2
Supplementary Information
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