CC(=O)NCCS(=O)C1=C(C(=O)OCc2ccccc2)N2C(=O)CC2C1
SMILES: CC(=O)NCCS(=O)C1=C(C(=O)OCc2ccccc2)N2C(=O)CC2C1

Molecular Processing

Molecular formula
C18H20N2O5S
Molecular weight
376.43
Exact mass
376.1093
XLogP
0.83
TPSA
92.78
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
26
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.389
Molar refractivity
94.83

Supplementary Information

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