Название: (2-{[4-(2-{[(tert-butyl)amino]sulfonyl}phenyl)phenyl]carbonylamino}-5-chlorophenyl)-N-(5-chloro(2-pyridyl))carboxamide
SMILES:
CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)cc1Molecular Processing
Molecular formula
C29H26Cl2N4O4S
Molecular weight
597.52
Exact mass
596.1052
XLogP
6.64
TPSA
117.26
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
40
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.138
Molar refractivity
158.56
Supplementary Information
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