SMILES:
COc1ccc(Br)cc1-c1cc(Cl)nc(N)n1Molecular Processing
Molecular formula
C11H9BrClN3O
Molecular weight
314.57
Exact mass
312.9618
XLogP
3.15
TPSA
61.03
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
71.14
Supplementary Information
Загрузка подробностей…
Участвует в 2 реакциях→