Name: {3-[2-(2-Fluoro-benzyl)-1,1-dioxo-1,2-dihydro-1λ6benzo[e][1,2,3]thiadiazin-4-yl]-5-fluoro-2-methyl-indol-1-yl}-acetic acid tert-butyl ester
SMILES:
Cc1c(C2=NN(Cc3ccccc3F)S(=O)(=O)c3ccccc32)c2cc(F)ccc2n1CC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C29H27F2N3O4S
Molecular weight
551.62
Exact mass
551.169
XLogP
5.53
TPSA
80.97
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
39
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.241
Molar refractivity
143.69
Supplementary Information
Details werden geladen…
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