Name: 4-(benzyl)sulfinyl-1,2-diaminobenzene
SMILES:
Nc1ccc(S(=O)Cc2ccccc2)cc1NMolecular Processing
Molecular formula
C13H14N2OS
Molecular weight
246.34
Exact mass
246.0827
XLogP
2.16
TPSA
69.11
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
71.82
Supplementary Information
Details werden geladen…
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