SMILES:
COc1cc(Nc2c(C#N)cnc3cc(I)sc23)c(Cl)cc1ClMolecular Processing
Molecular formula
C15H8Cl2IN3OS
Molecular weight
476.13
Exact mass
474.881
XLogP
5.83
TPSA
57.94
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
103.35
Supplementary Information
جارٍ جلب التفاصيل…
مشارك في 37 تفاعل→