CCS(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(-c4ccc(CNC(C)C)cc4)cc23)CC1
SMILES: CCS(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(-c4ccc(CNC(C)C)cc4)cc23)CC1

Molecular Processing

Molecular formula
C26H34N4O3S
Molecular weight
482.65
Exact mass
482.2352
XLogP
3.96
TPSA
108.29
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
137.24

Supplementary Information

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