SMILES:
CCN=C(c1ccc(OC)cc1)N1CCCc2cc(C3=NNC(=O)SC3(C)C)ccc21Molecular Processing
Molecular formula
C24H28N4O2S
Molecular weight
436.58
Exact mass
436.1933
XLogP
4.85
TPSA
66.29
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
31
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
128.92
Supplementary Information
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