SMILES:
CCOC(=O)C(CCSc1ccccc1)(NC(=O)c1ccccc1)C(=O)OCCMolecular Processing
Molecular formula
C22H25NO5S
Molecular weight
415.51
Exact mass
415.1453
XLogP
3.46
TPSA
81.7
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
29
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
111.69
Supplementary Information
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