SMILES:
O=C1NC(=O)C(c2ccc(NC(=O)c3ccc4c(c3)OCO4)cc2)S1Molecular Processing
Molecular formula
C17H12N2O5S
Molecular weight
356.36
Exact mass
356.0467
XLogP
2.69
TPSA
93.73
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
90.83
Supplementary Information
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