Name: title compound
SMILES:
Cc1cscc1-c1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)cn2)c2nccnc12Molecular Processing
Molecular formula
C25H26N6OS
Molecular weight
458.59
Exact mass
458.1889
XLogP
4.06
TPSA
74.25
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
33
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.28
Molar refractivity
132.55
Supplementary Information
Details werden geladen…
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