Nombre: 4,5-Diamino-3-chloro-2-phenylamino-benzoic acid methyl ester
SMILES:
COC(=O)c1cc(N)c(N)c(Cl)c1Nc1ccccc1Molecular Processing
Molecular formula
C14H14ClN3O2
Molecular weight
291.74
Exact mass
291.0775
XLogP
3.03
TPSA
90.37
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
81.34
Supplementary Information
No supplementary data available
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