N#Cc1cc(S(=O)(=O)Nc2ncns2)ccc1Oc1ccc(OC(F)(F)F)cc1I
Name: 3-cyano-N-(1,2,4-thiadiazol-5-yl)-4-[2-iodo-4-(trifluoromethoxy)phenoxy]benzenesulfonamide
SMILES: N#Cc1cc(S(=O)(=O)Nc2ncns2)ccc1Oc1ccc(OC(F)(F)F)cc1I

Molecular Processing

Molecular formula
C16H8F3IN4O4S2
Molecular weight
568.3
Exact mass
567.8984
XLogP
4.51
TPSA
114.2
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
107.79

Supplementary Information

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Involved in 7 reactions→

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