SMILES:
CSc1sc(C(=N)NC(=O)OC(C)(C)C)cc1S(=O)(=O)c1cccc(Br)c1Molecular Processing
Molecular formula
C17H19BrN2O4S3
Molecular weight
491.45
Exact mass
489.969
XLogP
4.92
TPSA
96.32
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
27
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
111.89
Supplementary Information
Details werden geladen…
An 60 Reaktionen beteiligt→