SMILES:
COC(=O)C1CCC(OC)(OC)CN1C(=O)c1sc(C)nc1-c1ccccc1Molecular Processing
Molecular formula
C20H24N2O5S
Molecular weight
404.49
Exact mass
404.1406
XLogP
2.89
TPSA
77.96
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
105.11
Supplementary Information
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