COc1ccc2sc(Nc3ccc(Br)cc3)nc2c1
Nom: (4-bromophenyl)(5-methoxybenzothiazol-2-yl)amine
SMILES: COc1ccc2sc(Nc3ccc(Br)cc3)nc2c1

Molecular Processing

Molecular formula
C14H11BrN2OS
Molecular weight
335.23
Exact mass
333.9775
XLogP
4.81
TPSA
34.15
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
83.6

Supplementary Information

Récupération des détails…

Impliqué dans 9 réactions