SMILES:
CS(=O)(=O)c1ccc(C(CC2CCC(=O)C2)c2cc3cccnc3[nH]2)cc1Molecular Processing
Molecular formula
C21H22N2O3S
Molecular weight
382.49
Exact mass
382.1351
XLogP
3.86
TPSA
79.89
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
27
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
104.45
Supplementary Information
Récupération des détails…
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