SMILES:
CCCCCCCCCC=C1OC(=O)N(CCCCSc2cccc3nccn23)C1=OMolecular Processing
Molecular formula
C24H33N3O3S
Molecular weight
443.61
Exact mass
443.2243
XLogP
6.21
TPSA
63.91
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
14
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.542
Molar refractivity
124.04
Supplementary Information
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