SMILES:
O=C1Nc2cc(C(=O)c3ccc(NC(=O)c4cccs4)cc3)ccc2C1=CNc1ccc(N2CCOCC2)cc1Molecular Processing
Molecular formula
C31H26N4O4S
Molecular weight
550.64
Exact mass
550.1675
XLogP
5.47
TPSA
99.77
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
40
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.129
Molar refractivity
158.29
Supplementary Information
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