CC(C)S(=O)(=O)NC1CC2=C(C1)C=C(C=C2)I
Name: N-(5-iodo-2,3-dihydro-1H-inden-2-yl)propane-2-sulfonamide
SMILES: CC(C)S(=O)(=O)NC1CC2=C(C1)C=C(C=C2)I

Molecular Processing

Molecular formula
C12H16INO2S
Molecular weight
365.24
Exact mass
364.9946
XLogP
2.09
TPSA
46.17
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
77.55

Supplementary Information

InChIKey: OIPKVVREUZUVSN-UHFFFAOYSA-N
Synonyme
SCHEMBL2935780OIPKVVREUZUVSN-UHFFFAOYSA-NN-(5-iodo-2,3-dihydro-1H-inden-2-yl)-2-propanesulfonamide
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