C140H118Cl11F6N21O22S8 — CID 158295477
N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-5-(3-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-5-(4-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-(2-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-(3-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-thiophen-2-ylpyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide (PubChem CID 158295477) has the molecular formula C140H118Cl11F6N21O22S8 and a molecular weight of 3207.12 g/mol. Its IUPAC name is N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-5-(3-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-5-(4-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-(2-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-(3-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-thiophen-2-ylpyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide.
| Compound Name | N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-5-(3-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-5-(4-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-(2-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-(3-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-thiophen-2-ylpyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide |
|---|---|
| PubChem CID | 158295477 |
| Molecular Formula | C140H118Cl11F6N21O22S8 |
| Molecular Weight | 3207.12 g/mol |
| Exact Mass | 3199.30 |
| IUPAC Name | N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-5-(3-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-5-(4-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-(2-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-(3-chlorophenyl)pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-thiophen-2-ylpyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide |
| SMILES | CNS(=O)(=O)c1ccc(CNC(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)nc2)c(Cl)c1.CNS(=O)(=O)c1ccc(CNC(=O)c2ccc(-c3ccc(OC(F)(F)F)cc3)nc2)c(Cl)c1.CNS(=O)(=O)c1ccc(CNC(=O)c2ccc(-c3cccc(Cl)c3)nc2)c(Cl)c1.CNS(=O)(=O)c1ccc(CNC(=O)c2ccc(-c3ccccc3Cl)nc2)c(Cl)c1.CNS(=O)(=O)c1ccc(CNC(=O)c2ccc(-c3cccs3)nc2)c(Cl)c1.CNS(=O)(=O)c1ccc(CNC(=O)c2cncc(-c3ccc(Cl)cc3)c2)c(Cl)c1.CNS(=O)(=O)c1ccc(CNC(=O)c2cncc(-c3cccc(Cl)c3)c2)c(Cl)c1 |
| InChI | InChI=1S/C21H17ClF3N3O4S.C21H17ClF3N3O3S.4C20H17Cl2N3O3S.C18H16ClN3O3S2/c1-26-33(30,31)17-8-4-14(18(22)10-17)11-28-20(29)15-5-9-19(27-12-15)13-2-6-16(7-3-13)32-21(23,24)25;1-26-32(30,31)17-8-4-14(18(22)10-17)11-28-20(29)15-5-9-19(27-12-15)13-2-6-16(7-3-13)21(23,24)25;1-23-29(27,28)18-7-4-14(19(22)9-18)12-25-20(26)16-8-15(10-24-11-16)13-2-5-17(21)6-3-13;1-23-29(27,28)17-7-5-14(18(22)10-17)11-25-20(26)15-6-8-19(24-12-15)13-3-2-4-16(21)9-13;1-23-29(27,28)18-6-5-14(19(22)9-18)12-25-20(26)16-7-15(10-24-11-16)13-3-2-4-17(21)8-13;1-23-29(27,28)15-8-6-13(18(22)10-15)11-25-20(26)14-7-9-19(24-12-14)16-4-2-3-5-17(16)21;1-20-27(24,25)14-6-4-12(15(19)9-14)10-22-18(23)13-5-7-16(21-11-13)17-3-2-8-26-17/h2-10,12,26H,11H2,1H3,(H,28,29);2-10,12,26H,11H2,1H3,(H,28,29);2-11,23H,12H2,1H3,(H,25,26);2-10,12,23H,11H2,1H3,(H,25,26);2-11,23H,12H2,1H3,(H,25,26);2-10,12,23H,11H2,1H3,(H,25,26);2-9,11,20H,10H2,1H3,(H,22,23) |
| InChIKey | GLVXTISTJAHXAP-UHFFFAOYSA-N |
| XLogP | 27.27 |
| TPSA | 626.35 Ų |
| H-Bond Donors | 14 |
| H-Bond Acceptors | 30 |
| Rotatable Bonds | 43 |
| Heavy Atoms | 208 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3207.12 |
| LogP ≤ 5 | 27.27 |
| H-Bond Donors ≤ 5 | 14 |
| H-Bond Acceptors ≤ 10 | 30 |