Name: ethyl 3-chloro-4-(N-((1-ethyl-1H-indazol-5-yl)methyl)sulfamoyl)benzoate
SMILES:
CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc3c(cnn3CC)c2)c(Cl)c1Molecular Processing
Molecular formula
C19H20ClN3O4S
Molecular weight
421.91
Exact mass
421.0863
XLogP
3.36
TPSA
90.29
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
106.84
Supplementary Information
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