SMILES:
CS(=O)(=O)Nc1ccc(-c2cnc(N3CCOCC3)c3nc(/C=C/c4ccc5ccccc5n4)cn23)cn1Molecular Processing
Molecular formula
C27H25N7O3S
Molecular weight
527.61
Exact mass
527.174
XLogP
3.72
TPSA
114.61
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
38
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.185
Molar refractivity
148.39
Supplementary Information
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