Common name
1-chloro-N-(2-chloro-4-fluorophenyl)methanesulfonamide
IUPAC name
1-chloro-N-(2-chloro-4-fluorophenyl)methanesulfonamide
SMILES
C(Cl)S(=O)(=O)Nc1c(cc(cc1)F)Cl
Common name
1-chloro-N-(2-chloro-4-fluorophenyl)methanesulfonamide
IUPAC name
1-chloro-N-(2-chloro-4-fluorophenyl)methanesulfonamide
SMILES
C(Cl)S(=O)(=O)Nc1c(cc(cc1)F)Cl
INCHI
InChI=1S/C7H6Cl2FNO2S/c8-4-14(12,13)11-7-2-1-5(10)3-6(7)9/h1-3,11H,4H2
FORMULA
C7H6Cl2FNO2S
Common name
1-chloro-N-(2-chloro-4-fluorophenyl)methanesulfonamide
IUPAC name
1-chloro-N-(2-chloro-4-fluorophenyl)methanesulfonamide
Molecular weight
258.097
clogP
1.993
clogS
-3.840
Frequency
0.0003
HBond Acceptor
2
HBond Donor
1
Total PolarSurface Area
46.17
Number of Rings
1
Rotatable Bond
3
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD02432 | profluazol |
|
Herbicide | Herbicide |
1 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4ehg_ligand_2_22.mol2 | 4ehg | 0.59375 | -6.96 | c1c(c(ccc1F)NS(=O)(=O)C)F | 13 |
| 4pp7_ligand_2_7.mol2 | 4pp7 | 0.59375 | -6.93 | CS(=O)(=O)Nc1c(cc(cc1)F)F | 13 |
| 4e4x_ligand_2_14.mol2 | 4e4x | 0.59375 | -6.87 | CS(=O)(=O)Nc1c(cc(cc1)F)F | 13 |
| 3c4c_ligand_2_1.mol2 | 3c4c | 0.59375 | -6.86 | CS(=O)(=O)Nc1c(F)cc(cc1)F | 13 |
| 4ehe_ligand_2_3.mol2 | 4ehe | 0.59375 | -6.81 | c1c(c(ccc1F)NS(=O)(=O)C)F | 13 |
| 4mbj_ligand_2_7.mol2 | 4mbj | 0.59375 | -6.51 | N(S(=O)(=O)C)c1c(cc(cc1)F)F | 13 |
117 ,
12
