SMILES:
CCS(=O)(=O)NCc1ccc2c(c1)C(Cc1ccccc1)C(NC1(C#N)COC1)CC2Molecular Processing
Molecular formula
C24H29N3O3S
Molecular weight
439.58
Exact mass
439.193
XLogP
2.65
TPSA
91.22
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
31
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
120.04
Supplementary Information
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