Name: 1-[4-(N-hydroxyamidino)-2,3-dihydro-1H-inden-1-ylideneamino]-2-amino-4-(4-chlorophenyl)-irnidazole dihydrochloride
SMILES:
Cl.Cl.N=C(NO)c1cccc2c1CCC2=Nn1cc(-c2ccc(Cl)cc2)nc1NMolecular Processing
Molecular formula
C19H19Cl3N6O
Molecular weight
453.76
Exact mass
452.0686
XLogP
4.13
TPSA
112.31
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
3
Fraction Csp3
0.105
Molar refractivity
120.03
Supplementary Information
Details werden geladen…
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