3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide

C110H101Cl2F4N9O17S5 — CID 167626657

About 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide

3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide (PubChem CID 167626657) has the molecular formula C110H101Cl2F4N9O17S5 and a molecular weight of 2128.30 g/mol. Its IUPAC name is 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide.

Molecular Properties

• Compound Name: 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide
• PubChem CID: 167626657
• Molecular Formula: C110H101Cl2F4N9O17S5
• Molecular Weight: 2128.30 g/mol
• Exact Mass: 2125.52
• IUPAC Name: 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide
• SMILES: Cc1cc(-c2ccccc2)cc(C(=O)CNS(=O)(=O)c2ccc(CO)cc2)c1F.Cc1cc(-c2ccccc2)cc(C(=O)Cc2nnc3n2CCCC3)c1F.Cc1cc(-c2ccccc2)cc(C(=O)NS(=O)(=O)N2CCCC2)c1F.Cc1ccccc1C(=O)CNS(=O)(=O)c1ccccc1.O=C(CNS(=O)(=O)c1cccc(Cl)c1)c1cc(-c2ccccc2)ccc1F.O=C(CNS(=O)(=O)c1ccccc1)c1ccccc1Cl
• InChI: InChI=1S/C22H20FNO4S.C21H20FN3O.C20H15ClFNO3S.C18H19FN2O3S.C15H15NO3S.C14H12ClNO3S/c1-15-11-18(17-5-3-2-4-6-17)12-20(22(15)23)21(26)13-24-29(27,28)19-9-7-16(14-25)8-10-19;1-14-11-16(15-7-3-2-4-8-15)12-17(21(14)22)18(26)13-20-24-23-19-9-5-6-10-25(19)20;21-16-7-4-8-17(12-16)27(25,26)23-13-20(24)18-11-15(9-10-19(18)22)14-5-2-1-3-6-14;1-13-11-15(14-7-3-2-4-8-14)12-16(17(13)19)18(22)20-25(23,24)21-9-5-6-10-21;1-12-7-5-6-10-14(12)15(17)11-16-20(18,19)13-8-3-2-4-9-13;15-13-9-5-4-8-12(13)14(17)10-16-20(18,19)11-6-2-1-3-7-11/h2-12,24-25H,13-14H2,1H3;2-4,7-8,11-12H,5-6,9-10,13H2,1H3;1-12,23H,13H2;2-4,7-8,11-12H,5-6,9-10H2,1H3,(H,20,22);2-10,16H,11H2,1H3;1-9,16H,10H2
• InChIKey: NETSRKOGBSHFOM-UHFFFAOYSA-N
• XLogP: 19.45
• TPSA: 387.45 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 20
• Rotatable Bonds: 31
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2128.30
LogP ≤ 5	19.45
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide?

The IUPAC name of 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide (CID 167626657) is 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide.

What is the SMILES notation for 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide?

The canonical SMILES for 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide is Cc1cc(-c2ccccc2)cc(C(=O)CNS(=O)(=O)c2ccc(CO)cc2)c1F.Cc1cc(-c2ccccc2)cc(C(=O)Cc2nnc3n2CCCC3)c1F.Cc1cc(-c2ccccc2)cc(C(=O)NS(=O)(=O)N2CCCC2)c1F.Cc1ccccc1C(=O)CNS(=O)(=O)c1ccccc1.O=C(CNS(=O)(=O)c1cccc(Cl)c1)c1cc(-c2ccccc2)ccc1F.O=C(CNS(=O)(=O)c1ccccc1)c1ccccc1Cl.

What is the InChIKey of 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide?

The InChIKey is NETSRKOGBSHFOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FNO4S.C21H20FN3O.C20H15ClFNO3S.C18H19FN2O3S.C15H15NO3S.C14H12ClNO3S/c1-15-11-18(17-5-3-2-4-6-17)12-20(22(15)23)21(26)13-24-29(27,28)19-9-7-16(14-25)8-10-19;1-14-11-16(15-7-3-2-4-8-15)12-17(21(14)22)18(26)13-20-24-23-19-9-5-6-10-25(19)20;21-16-7-4-8-17(12-16)27(25,26)23-13-20(24)18-11-15(9-10-19(18)22)14-5-2-1-3-6-14;1-13-11-15(14-7-3-2-4-8-14)12-16(17(13)19)18(22)20-25(23,24)21-9-5-6-10-21;1-12-7-5-6-10-14(12)15(17)11-16-20(18,19)13-8-3-2-4-9-13;15-13-9-5-4-8-12(13)14(17)10-16-20(18,19)11-6-2-1-3-7-11/h2-12,24-25H,13-14H2,1H3;2-4,7-8,11-12H,5-6,9-10,13H2,1H3;1-12,23H,13H2;2-4,7-8,11-12H,5-6,9-10H2,1H3,(H,20,22);2-10,16H,11H2,1H3;1-9,16H,10H2.

What are the key properties of 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide?

3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide has a molecular weight of 2128.30 g/mol, XLogP of 19.45, 31 rotatable bonds, 6 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-N-[2-(2-fluoro-5-phenylphenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-chlorophenyl)-2-oxoethyl]benzenesulfonamide;N-[2-(2-fluoro-3-methyl-5-phenylphenyl)-2-oxoethyl]-4-(hydroxymethyl)benzenesulfonamide;1-(2-fluoro-3-methyl-5-phenylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanone;2-fluoro-3-methyl-5-phenyl-N-pyrrolidin-1-ylsulfonylbenzamide;N-[2-(2-methylphenyl)-2-oxoethyl]benzenesulfonamide is sourced from PubChem (CID 167626657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).