CC(C)(C)OC(=O)COc1cccc(CN(Cc2ccc(-n3cccn3)cc2)S(=O)(=O)c2ccc(Cl)cc2)c1
SMILES: CC(C)(C)OC(=O)COc1cccc(CN(Cc2ccc(-n3cccn3)cc2)S(=O)(=O)c2ccc(Cl)cc2)c1

Molecular Processing

Molecular formula
C29H30ClN3O5S
Molecular weight
568.1
Exact mass
567.1595
XLogP
5.64
TPSA
90.73
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
39
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.241
Molar refractivity
149.23

Supplementary Information

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