Clc1nc(N2CC3CCC(C2)O3)cc(N2CC3CCC(C2)O3)n1
SMILES: Clc1nc(N2CC3CCC(C2)O3)cc(N2CC3CCC(C2)O3)n1

Molecular Processing

Molecular formula
C16H21ClN4O2
Molecular weight
336.82
Exact mass
336.1353
XLogP
1.87
TPSA
50.72
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
23
Rings
5
Aromatic rings
1
Saturated rings
4
Aliphatic rings
4
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
87.26

Supplementary Information

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