Name: 4-(p-carboxyanilino)-3-nitro-5-sulphamyl-benzoic acid
SMILES:
NS(=O)(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1Nc1ccc(C(=O)O)cc1Molecular Processing
Molecular formula
C14H11N3O8S
Molecular weight
381.32
Exact mass
381.0267
XLogP
1.38
TPSA
189.93
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0
Molar refractivity
88.11
Supplementary Information
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