Nom: mixture
SMILES:
CCOC(/C=C/c1cnc(N)c2c(Br)csc12)OCCMolecular Processing
Molecular formula
C14H17BrN2O2S
Molecular weight
357.27
Exact mass
356.0194
XLogP
4.05
TPSA
57.37
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
20
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
0.357
Molar refractivity
87.81
Supplementary Information
Récupération des détails…
Impliqué dans 7 réactions→