CC(C)(C)OC(=O)N1CC=C(c2cc(C(F)(F)F)ccc2-c2cccc3c2CCN(S(=O)(=O)Nc2nccs2)C3)CC1
SMILES: CC(C)(C)OC(=O)N1CC=C(c2cc(C(F)(F)F)ccc2-c2cccc3c2CCN(S(=O)(=O)Nc2nccs2)C3)CC1

Molecular Processing

Molecular formula
C29H31F3N4O4S2
Molecular weight
620.72
Exact mass
620.1739
XLogP
6.57
TPSA
91.84
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
42
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.379
Molar refractivity
156.05

Supplementary Information

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