SMILES:
COC(=O)CNCCn1c(=O)n(Cc2csc3cccc(C)c23)c2ccccc21Molecular Processing
Molecular formula
C22H23N3O3S
Molecular weight
409.51
Exact mass
409.146
XLogP
3.14
TPSA
65.26
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
29
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
116.75
Supplementary Information
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