SMILES:
OC1CCN(c2ncc(Br)cn2)CC1Molecular Processing
Molecular formula
C9H12BrN3O
Molecular weight
258.12
Exact mass
257.0164
XLogP
1.2
TPSA
49.25
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
57.19
Supplementary Information
جارٍ جلب التفاصيل…
مشارك في 6 تفاعل→