4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide

C78H46Cl9F14N9O15S6 — CID 157287969

IUPAC4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide
SMILESCS(=O)(=O)c1ccccc1C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.CS(=O)c1ccccc1C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.Cc1ncc(Cl)cc1C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.O=C(c1ccc(F)cc1F)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1
InChIInChI=1S/C20H13Cl2F3N2O5S2.C20H13Cl2F3N2O4S2.C19H11Cl3F3N3O3S.C19H9Cl2F5N2O3S/c1-33(29,30)17-5-3-2-4-13(17)19(28)18-16(8-11(21)10-26-18)27-34(31,32)12-6-7-15(22)14(9-12)20(23,24)25;1-32(29)17-5-3-2-4-13(17)19(28)18-16(8-11(21)10-26-18)27-33(30,31)12-6-7-15(22)14(9-12)20(23,24)25;1-9-13(4-10(20)7-26-9)18(29)17-16(5-11(21)8-27-17)28-32(30,31)12-2-3-15(22)14(6-12)19(23,24)25;20-9-5-16(17(27-8-9)18(29)12-3-1-10(22)6-15(12)23)28-32(30,31)11-2-4-14(21)13(7-11)19(24,25)26/h2-10,27H,1H3;2-10,27H,1H3;2-8,28H,1H3;1-8,28H
InChIKeyBALRHCQPONTIFN-UHFFFAOYSA-N
MW2126.72 g/mol
LogP21.53
Rot. Bonds22

About 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide

4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide (PubChem CID 157287969) has the molecular formula C78H46Cl9F14N9O15S6 and a molecular weight of 2126.72 g/mol. Its IUPAC name is 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide
PubChem CID157287969
Molecular FormulaC78H46Cl9F14N9O15S6
Molecular Weight2126.72 g/mol
Exact Mass2120.84
IUPAC Name4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide
SMILESCS(=O)(=O)c1ccccc1C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.CS(=O)c1ccccc1C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.Cc1ncc(Cl)cc1C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.O=C(c1ccc(F)cc1F)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1
InChIInChI=1S/C20H13Cl2F3N2O5S2.C20H13Cl2F3N2O4S2.C19H11Cl3F3N3O3S.C19H9Cl2F5N2O3S/c1-33(29,30)17-5-3-2-4-13(17)19(28)18-16(8-11(21)10-26-18)27-34(31,32)12-6-7-15(22)14(9-12)20(23,24)25;1-32(29)17-5-3-2-4-13(17)19(28)18-16(8-11(21)10-26-18)27-33(30,31)12-6-7-15(22)14(9-12)20(23,24)25;1-9-13(4-10(20)7-26-9)18(29)17-16(5-11(21)8-27-17)28-32(30,31)12-2-3-15(22)14(6-12)19(23,24)25;20-9-5-16(17(27-8-9)18(29)12-3-1-10(22)6-15(12)23)28-32(30,31)11-2-4-14(21)13(7-11)19(24,25)26/h2-10,27H,1H3;2-10,27H,1H3;2-8,28H,1H3;1-8,28H
InChIKeyBALRHCQPONTIFN-UHFFFAOYSA-N
XLogP21.53
TPSA368.62 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds22
Heavy Atoms131
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002126.72
LogP ≤ 521.53
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Analyze 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide with MolForge

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Related Compounds

4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)pyridin-3-yl]-3-(trifluoromethyl)benzenesulfonamide
CID 11497499
4-chloro-N-[5-chloro-2-(2-methyl-6-methylsulfonylbenzoyl)pyridin-3-yl]-3-(trifluoromethyl)benzenesulfonamide
CID 11497819
4-chloro-N-[5-chloro-2-(3-methylsulfonylbenzoyl)pyridin-3-yl]-3-(trifluoromethyl)benzenesulfonamide
CID 11555803
4-Chloro-N-[5-chloro-2-(2-methanesulfonyl-benzoyl)-pyridin-3-yl]-3-trifluoromethyl-benzenesulfonamide
CID 11613713
4-chloro-N-[5-chloro-2-(2-methyl-6-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfinamide
CID 143262669
[5-Chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-[4-chloronio-3-(trifluoromethyl)phenyl]sulfonylazanium
CID 143610564
4-chloro-N-[5-chloro-2-(2-methyl-1-oxidopyridin-1-ium-4-carbonyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methyl-1-oxidopyridin-1-ium-4-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide
CID 157052672
4-chloro-N-[5-chloro-2-(2-nitrobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide
CID 157140953
4-chloro-N-[5-chloro-2-(2-ethylbenzoyl)-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-6-methyl-2-(2-methylsulfanylbenzoyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane
CID 157159692
4-chloro-N-[5-chloro-2-(2,4-dimethylpyridine-3-carbonyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(1-hydroxy-2,4-dimethylpyridin-1-ium-3-carbonyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide
CID 157205920
4-chloro-N-[5-chloro-2-(2-chloro-5-methylbenzoyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-chloro-5-methylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide
CID 157318292
4-chloro-N-[5-chloro-2-(7H-cyclopenta[b]pyridine-4-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-(7H-cyclopenta[b]pyridine-4-carbonyl)-5-methyl-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;methane
CID 157329571

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide?
The IUPAC name of 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide (CID 157287969) is 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide.
What is the SMILES notation for 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide?
The canonical SMILES for 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide is CS(=O)(=O)c1ccccc1C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.CS(=O)c1ccccc1C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.Cc1ncc(Cl)cc1C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.O=C(c1ccc(F)cc1F)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.
What is the InChIKey of 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide?
The InChIKey is BALRHCQPONTIFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13Cl2F3N2O5S2.C20H13Cl2F3N2O4S2.C19H11Cl3F3N3O3S.C19H9Cl2F5N2O3S/c1-33(29,30)17-5-3-2-4-13(17)19(28)18-16(8-11(21)10-26-18)27-34(31,32)12-6-7-15(22)14(9-12)20(23,24)25;1-32(29)17-5-3-2-4-13(17)19(28)18-16(8-11(21)10-26-18)27-33(30,31)12-6-7-15(22)14(9-12)20(23,24)25;1-9-13(4-10(20)7-26-9)18(29)17-16(5-11(21)8-27-17)28-32(30,31)12-2-3-15(22)14(6-12)19(23,24)25;20-9-5-16(17(27-8-9)18(29)12-3-1-10(22)6-15(12)23)28-32(30,31)11-2-4-14(21)13(7-11)19(24,25)26/h2-10,27H,1H3;2-10,27H,1H3;2-8,28H,1H3;1-8,28H.
What are the key properties of 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide?
4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide has a molecular weight of 2126.72 g/mol, XLogP of 21.53, 22 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[5-chloro-2-(5-chloro-2-methylpyridine-3-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2,4-difluorobenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfinylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-(2-methylsulfonylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide is sourced from PubChem (CID 157287969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).