Name: 2-(4-chloro-3-nitrobenzoyl)-N-[5-[(ethylamino)sulfonyl]-2-methoxyphenyl]-benzamide
SMILES:
CCNS(=O)(=O)c1ccc(OC)c(NC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1Molecular Processing
Molecular formula
C23H20ClN3O7S
Molecular weight
517.95
Exact mass
517.071
XLogP
4.04
TPSA
144.71
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
35
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.13
Molar refractivity
129.79
Supplementary Information
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