SMILES:
COCCSc1cc(C)nc(N(C)C(=O)NS(=O)(=O)c2ccccc2[N+](=O)[O-])n1Molecular Processing
Molecular formula
C16H19N5O6S2
Molecular weight
441.49
Exact mass
441.0777
XLogP
1.97
TPSA
144.63
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
8
Heavy atoms
29
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
106.59
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→