SMILES:
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H](C1)c1cc(-c3c(F)cccc3Cl)cc3c1N2CCS3Molecular Processing
Molecular formula
C24H26ClFN2O2S
Molecular weight
461
Exact mass
460.1388
XLogP
6.16
TPSA
32.78
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
31
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
123.87
Supplementary Information
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