SMILES:
CSCCC(NC(=O)Cc1ccccc1)C(=O)OCC(C)CMolecular Processing
Molecular formula
C17H25NO3S
Molecular weight
323.46
Exact mass
323.1555
XLogP
2.67
TPSA
55.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
9
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
90.87
Supplementary Information
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