C=C(CCO)CN(c1ccc(Cl)cc1I)S(C)(=O)=O
Name: N-(4-Chloro-2-iodo-phenyl)-N-(4-hydroxy-2-methylene-butyl)-methanesulfonamide
SMILES: C=C(CCO)CN(c1ccc(Cl)cc1I)S(C)(=O)=O

Molecular Processing

Molecular formula
C12H15ClINO3S
Molecular weight
415.68
Exact mass
414.9506
XLogP
2.65
TPSA
57.61
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
87.2

Supplementary Information

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