SMILES:
COC(=O)C1Cc2ccccc2N1C(=O)C(C)CSC(C)=OMolecular Processing
Molecular formula
C16H19NO4S
Molecular weight
321.4
Exact mass
321.1035
XLogP
2.03
TPSA
63.68
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
85.74
Supplementary Information
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