2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide

C₈₇H₆₀Cl₈FN₁₃O₉S₃ — CID 158143514

About 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide

2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide (PubChem CID 158143514) has the molecular formula C₈₇H₆₀Cl₈FN₁₃O₉S₃ and a molecular weight of 1830.34 g/mol. Its IUPAC name is 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide
• PubChem CID: 158143514
• Molecular Formula: C₈₇H₆₀Cl₈FN₁₃O₉S₃
• Molecular Weight: 1830.34 g/mol
• Exact Mass: 1825.13
• IUPAC Name: 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide
• SMILES: CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)s1.NS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(Cl)nc1Cl.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccccc1Cl.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1cccnc1F
• InChI: InChI=1S/C18H12Cl2N2O.C18H14ClN3O3S.C17H10Cl3N3O.C17H11ClFN3O.C17H13ClN2O3S2/c19-15-6-2-1-5-13(15)18(23)22-12-8-9-16(20)14(11-12)17-7-3-4-10-21-17;19-16-9-6-13(11-15(16)17-3-1-2-10-21-17)22-18(23)12-4-7-14(8-5-12)26(20,24)25;18-13-6-4-10(9-12(13)14-3-1-2-8-21-14)22-17(24)11-5-7-15(19)23-16(11)20;18-14-7-6-11(10-13(14)15-5-1-2-8-20-15)22-17(23)12-4-3-9-21-16(12)19;1-25(22,23)16-8-7-15(24-16)17(21)20-11-5-6-13(18)12(10-11)14-4-2-3-9-19-14/h1-11H,(H,22,23);1-11H,(H,22,23)(H2,20,24,25);1-9H,(H,22,24);1-10H,(H,22,23);2-10H,1H3,(H,20,21)
• InChIKey: FUFSDGZDOGDBSN-UHFFFAOYSA-N
• XLogP: 22.27
• TPSA: 330.03 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 17
• Rotatable Bonds: 17
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1830.34
LogP ≤ 5	22.27
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide?

The IUPAC name of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide (CID 158143514) is 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide.

What is the SMILES notation for 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide?

The canonical SMILES for 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide is CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)s1.NS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(Cl)nc1Cl.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccccc1Cl.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1cccnc1F.

What is the InChIKey of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide?

The InChIKey is FUFSDGZDOGDBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl2N2O.C18H14ClN3O3S.C17H10Cl3N3O.C17H11ClFN3O.C17H13ClN2O3S2/c19-15-6-2-1-5-13(15)18(23)22-12-8-9-16(20)14(11-12)17-7-3-4-10-21-17;19-16-9-6-13(11-15(16)17-3-1-2-10-21-17)22-18(23)12-4-7-14(8-5-12)26(20,24)25;18-13-6-4-10(9-12(13)14-3-1-2-8-21-14)22-17(24)11-5-7-15(19)23-16(11)20;18-14-7-6-11(10-13(14)15-5-1-2-8-20-15)22-17(23)12-4-3-9-21-16(12)19;1-25(22,23)16-8-7-15(24-16)17(21)20-11-5-6-13(18)12(10-11)14-4-2-3-9-19-14/h1-11H,(H,22,23);1-11H,(H,22,23)(H2,20,24,25);1-9H,(H,22,24);1-10H,(H,22,23);2-10H,1H3,(H,20,21).

What are the key properties of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide?

2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide has a molecular weight of 1830.34 g/mol, XLogP of 22.27, 17 rotatable bonds, 6 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 158143514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 158143514 — identifiers, structure, computed properties (public domain)

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