SMILES:
CCS(=O)c1ncc(C(=O)NCCC2C3CCC2CC3)s1Molecular Processing
Molecular formula
C15H22N2O2S2
Molecular weight
326.49
Exact mass
326.1123
XLogP
2.83
TPSA
59.06
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
21
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.733
Molar refractivity
84.95
Supplementary Information
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