COc1ccc(S(=O)(=O)Oc2ccc(-c3cc4cc(CN5CCCCC5)ccc4n3C(=O)OC(C)(C)C)c3c2CNC3=O)cc1OC
SMILES: COc1ccc(S(=O)(=O)Oc2ccc(-c3cc4cc(CN5CCCCC5)ccc4n3C(=O)OC(C)(C)C)c3c2CNC3=O)cc1OC

Molecular Processing

Molecular formula
C35H39N3O8S
Molecular weight
661.78
Exact mass
661.2458
XLogP
6.11
TPSA
125.4
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
8
Heavy atoms
47
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.371
Molar refractivity
176.66

Supplementary Information

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