2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide

C79H62Cl5N17O8S2 — CID 158674492

About 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide

2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide (PubChem CID 158674492) has the molecular formula C79H62Cl5N17O8S2 and a molecular weight of 1618.87 g/mol. Its IUPAC name is 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide.

Molecular Properties

• Compound Name: 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide
• PubChem CID: 158674492
• Molecular Formula: C79H62Cl5N17O8S2
• Molecular Weight: 1618.87 g/mol
• Exact Mass: 1615.29
• IUPAC Name: 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide
• SMILES: CS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.CS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cn1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(Cn2ccnn2)cc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(Cn2cncn2)cc1
• InChI: InChI=1S/2C21H16ClN5O.C19H15Cl2N3O3S.C18H15ClN4O3S/c22-19-9-8-17(11-18(19)20-3-1-2-10-24-20)26-21(28)16-6-4-15(5-7-16)12-27-14-23-13-25-27;22-19-9-8-17(13-18(19)20-3-1-2-10-23-20)25-21(28)16-6-4-15(5-7-16)14-27-12-11-24-26-27;1-28(26,27)24-13-5-7-14(17(21)11-13)19(25)23-12-6-8-16(20)15(10-12)18-4-2-3-9-22-18;1-27(25,26)23-17-8-5-12(11-21-17)18(24)22-13-6-7-15(19)14(10-13)16-4-2-3-9-20-16/h1-11,13-14H,12H2,(H,26,28);1-13H,14H2,(H,25,28);2-11,24H,1H3,(H,23,25);2-11H,1H3,(H,21,23)(H,22,24)
• InChIKey: IEIQLKNSUIAKPI-UHFFFAOYSA-N
• XLogP: 16.69
• TPSA: 334.61 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 19
• Rotatable Bonds: 20
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1618.87
LogP ≤ 5	16.69
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide?

The IUPAC name of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide (CID 158674492) is 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide.

What is the SMILES notation for 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide?

The canonical SMILES for 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide is CS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.CS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cn1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(Cn2ccnn2)cc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(Cn2cncn2)cc1.

What is the InChIKey of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide?

The InChIKey is IEIQLKNSUIAKPI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C21H16ClN5O.C19H15Cl2N3O3S.C18H15ClN4O3S/c22-19-9-8-17(11-18(19)20-3-1-2-10-24-20)26-21(28)16-6-4-15(5-7-16)12-27-14-23-13-25-27;22-19-9-8-17(13-18(19)20-3-1-2-10-23-20)25-21(28)16-6-4-15(5-7-16)14-27-12-11-24-26-27;1-28(26,27)24-13-5-7-14(17(21)11-13)19(25)23-12-6-8-16(20)15(10-12)18-4-2-3-9-22-18;1-27(25,26)23-17-8-5-12(11-21-17)18(24)22-13-6-7-15(19)14(10-13)16-4-2-3-9-20-16/h1-11,13-14H,12H2,(H,26,28);1-13H,14H2,(H,25,28);2-11,24H,1H3,(H,23,25);2-11H,1H3,(H,21,23)(H,22,24).

What are the key properties of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide?

2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide has a molecular weight of 1618.87 g/mol, XLogP of 16.69, 20 rotatable bonds, 6 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(methanesulfonamido)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(triazol-1-ylmethyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide is sourced from PubChem (CID 158674492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).