SMILES:
CCCCc1nc2c(N)nc3ccccc3c2n1CCCCNS(=O)(=O)c1cccc2c(N(C)C)cccc12Molecular Processing
Molecular formula
C30H36N6O2S
Molecular weight
544.73
Exact mass
544.262
XLogP
5.49
TPSA
106.14
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
39
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
160.76
Supplementary Information
Details werden geladen…
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