Name: title compound
SMILES:
C[C@H](CSc1nc2ccccc2o1)Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OMolecular Processing
Molecular formula
C20H21ClN6O5S
Molecular weight
492.95
Exact mass
492.0983
XLogP
1.83
TPSA
151.58
H-bond donors
4
H-bond acceptors
11
Rotatable bonds
7
Heavy atoms
33
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
121.16
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→