SMILES:
CCC1CNCCCN1S(=O)(=O)c1cccc2cncc(C)c12.ClMolecular Processing
Molecular formula
C17H24ClN3O2S
Molecular weight
369.92
Exact mass
369.1278
XLogP
2.73
TPSA
62.3
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
2
Fraction Csp3
0.471
Molar refractivity
99.19
Supplementary Information
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