Nombre: N-(2-diethylamino-ethyl)-5-iodo-4-butanesulfonylamino-2-methoxy-benzamide
SMILES:
CCCCS(=O)(=O)Nc1cc(OC)c(C(=O)NCCN(CC)CC)cc1IMolecular Processing
Molecular formula
C18H30IN3O4S
Molecular weight
511.43
Exact mass
511.1002
XLogP
2.91
TPSA
87.74
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
12
Heavy atoms
27
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
118.15
Supplementary Information
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