Name: N-[1-(ethylsulfanyl)isobutylidene]-4-bromoaniline
SMILES:
CCSC(=Nc1ccc(Br)cc1)C(C)CMolecular Processing
Molecular formula
C12H16BrNS
Molecular weight
286.24
Exact mass
285.0187
XLogP
4.89
TPSA
12.36
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
74.21
Supplementary Information
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