CS(=O)(=O)NC1CCCCC1Nc1nc(Nc2ccc3c(c2)CCN(CC(O)C(F)(F)F)CC3)ncc1Cl
SMILES: CS(=O)(=O)NC1CCCCC1Nc1nc(Nc2ccc3c(c2)CCN(CC(O)C(F)(F)F)CC3)ncc1Cl

Molecular Processing

Molecular formula
C24H32ClF3N6O3S
Molecular weight
577.07
Exact mass
576.1897
XLogP
3.47
TPSA
119.48
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
38
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
140.32

Supplementary Information

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