Name: 2-[(2-cyanophenyl)thio]-N-[5-[(dimethylamino)sulfonyl]-2,3-dimethylphenyl]-benzamide
SMILES:
Cc1cc(S(=O)(=O)N(C)C)cc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1CMolecular Processing
Molecular formula
C24H23N3O3S2
Molecular weight
465.6
Exact mass
465.1181
XLogP
4.83
TPSA
90.27
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
32
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
0.167
Molar refractivity
126.46
Supplementary Information
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