SMILES:
Clc1ncc2c(-c3cccc(Br)c3)n[nH]c2n1Molecular Processing
Molecular formula
C11H6BrClN4
Molecular weight
309.55
Exact mass
307.9464
XLogP
3.44
TPSA
54.46
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
17
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
69.83
Supplementary Information
Récupération des détails…
Impliqué dans 6 réactions→