CCOC(=O)CCN(C)C(=O)c1ccc(NC(CCCCS(C)(=O)=O)c2oc3ccc(OC)cc3c2C)cc1
SMILES: CCOC(=O)CCN(C)C(=O)c1ccc(NC(CCCCS(C)(=O)=O)c2oc3ccc(OC)cc3c2C)cc1

Molecular Processing

Molecular formula
C29H38N2O7S
Molecular weight
558.7
Exact mass
558.24
XLogP
5.14
TPSA
115.15
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
14
Heavy atoms
39
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.448
Molar refractivity
152.08

Supplementary Information

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