SMILES:
CC(C)(C)OC(=O)N1C2CCC1CN(c1ccc(N3CCN(S(C)(=O)=O)CC3)cc1)C2Molecular Processing
Molecular formula
C22H34N4O4S
Molecular weight
450.61
Exact mass
450.2301
XLogP
2.36
TPSA
73.4
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
31
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.682
Molar refractivity
122.17
Supplementary Information
Obteniendo detalles…
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