CNC(=O)c1nn(C)c2c1C(C)(C)Cc1cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc1-2.Cl.Cl.Cl
SMILES: CNC(=O)c1nn(C)c2c1C(C)(C)Cc1cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc1-2.Cl.Cl.Cl

Molecular Processing

Molecular formula
C25H35Cl3N8O
Molecular weight
569.97
Exact mass
568.1999
XLogP
3.83
TPSA
91.21
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
37
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
4
Fraction Csp3
0.44
Molar refractivity
155.53

Supplementary Information

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