SMILES:
N#Cc1cccc(C2=Nc3cc(N4CCSCC4)c(C#Cc4ccccc4)cc3NC(=O)C2)c1Molecular Processing
Molecular formula
C28H22N4OS
Molecular weight
462.58
Exact mass
462.1514
XLogP
4.97
TPSA
68.49
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
34
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.179
Molar refractivity
139
Supplementary Information
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Involved in 1 reactions→