CCOC(=O)CN(C(=O)c1ccc2sc(CCc3ccc(C(=N)N)cc3)nc2c1)c1ccccn1.Cl.Cl
SMILES: CCOC(=O)CN(C(=O)c1ccc2sc(CCc3ccc(C(=N)N)cc3)nc2c1)c1ccccn1.Cl.Cl

Molecular Processing

Molecular formula
C26H27Cl2N5O3S
Molecular weight
560.51
Exact mass
559.1212
XLogP
4.81
TPSA
122.26
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
37
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
3
Fraction Csp3
0.192
Molar refractivity
151.53

Supplementary Information

Details werden geladen…

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