CC(C)(Sc1nc(CC(=O)OCC2c3ccccc3-c3ccccc32)cs1)C(=O)O
SMILES: CC(C)(Sc1nc(CC(=O)OCC2c3ccccc3-c3ccccc32)cs1)C(=O)O

Molecular Processing

Molecular formula
C23H21NO4S2
Molecular weight
439.56
Exact mass
439.0912
XLogP
5
TPSA
76.49
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.261
Molar refractivity
118.07

Supplementary Information

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