Name: 2-amino-N-(4-chloro-3-(pyridin-2-yl)phenyl)-4-(methylsulfonyl)benzamide
SMILES:
CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(N)c1Molecular Processing
Molecular formula
C19H16ClN3O3S
Molecular weight
401.88
Exact mass
401.0601
XLogP
3.64
TPSA
102.15
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.053
Molar refractivity
106.6
Supplementary Information
Details werden geladen…
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