CC(C)(C)OC(=O)Nc1ccc(CN2C(=O)C(Nc3ccc(OC(F)F)cc3)=C(c3ccccc3)S2(=O)=O)cn1
SMILES: CC(C)(C)OC(=O)Nc1ccc(CN2C(=O)C(Nc3ccc(OC(F)F)cc3)=C(c3ccccc3)S2(=O)=O)cn1

Molecular Processing

Molecular formula
C27H26F2N4O6S
Molecular weight
572.59
Exact mass
572.1541
XLogP
5.18
TPSA
126.93
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
40
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
143.62

Supplementary Information

Details werden geladen…

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