CC(CN(C)C)NC(=O)c1cccc(CS(=O)(=O)C=C2CN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)C2)c1
SMILES: CC(CN(C)C)NC(=O)c1cccc(CS(=O)(=O)C=C2CN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)C2)c1

Molecular Processing

Molecular formula
C30H33Cl2N3O3S
Molecular weight
586.59
Exact mass
585.162
XLogP
5.58
TPSA
69.72
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
39
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
158.95

Supplementary Information

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