SMILES:
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(C(C(N)=O)C(C)c3ccccc3N3CCCCC3)cc2)cc1Molecular Processing
Molecular formula
C29H34N4O4S
Molecular weight
534.68
Exact mass
534.2301
XLogP
3.98
TPSA
121.6
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.31
Molar refractivity
148.27
Supplementary Information
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