SMILES:
CC(=O)Nc1nc(C)c(I)s1Molecular Processing
Molecular formula
C6H7IN2OS
Molecular weight
282.11
Exact mass
281.9324
XLogP
2.01
TPSA
41.99
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
53.87
Supplementary Information
Details werden geladen…
An 19 Reaktionen beteiligt→