2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide

C85H70Cl8N10O11S2 — CID 158616251

IUPAC2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide
SMILESCC(C)S(=O)(=O)Cc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.CCS(=O)(=O)Cc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(NO)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(C(=O)N2CCCC2)cc1Cl
InChIInChI=1S/C23H19Cl2N3O2.C22H20Cl2N2O3S.C21H18Cl2N2O3S.C19H13Cl2N3O3/c24-19-9-7-16(14-18(19)21-5-1-2-10-26-21)27-22(29)17-8-6-15(13-20(17)25)23(30)28-11-3-4-12-28;1-14(2)30(28,29)13-15-6-8-17(20(24)11-15)22(27)26-16-7-9-19(23)18(12-16)21-5-3-4-10-25-21;1-2-29(27,28)13-14-6-8-16(19(23)11-14)21(26)25-15-7-9-18(22)17(12-15)20-5-3-4-10-24-20;20-15-7-5-12(10-14(15)17-3-1-2-8-22-17)23-19(26)13-6-4-11(9-16(13)21)18(25)24-27/h1-2,5-10,13-14H,3-4,11-12H2,(H,27,29);3-12,14H,13H2,1-2H3,(H,26,27);3-12H,2,13H2,1H3,(H,25,26);1-10,27H,(H,23,26)(H,24,25)
InChIKeyHXKSBEVARICBLU-UHFFFAOYSA-N
MW1755.31 g/mol
LogP20.84
Rot. Bonds20

About 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide

2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide (PubChem CID 158616251) has the molecular formula C85H70Cl8N10O11S2 and a molecular weight of 1755.31 g/mol. Its IUPAC name is 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide
PubChem CID158616251
Molecular FormulaC85H70Cl8N10O11S2
Molecular Weight1755.31 g/mol
Exact Mass1750.22
IUPAC Name2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide
SMILESCC(C)S(=O)(=O)Cc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.CCS(=O)(=O)Cc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(NO)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(C(=O)N2CCCC2)cc1Cl
InChIInChI=1S/C23H19Cl2N3O2.C22H20Cl2N2O3S.C21H18Cl2N2O3S.C19H13Cl2N3O3/c24-19-9-7-16(14-18(19)21-5-1-2-10-26-21)27-22(29)17-8-6-15(13-20(17)25)23(30)28-11-3-4-12-28;1-14(2)30(28,29)13-15-6-8-17(20(24)11-15)22(27)26-16-7-9-19(23)18(12-16)21-5-3-4-10-25-21;1-2-29(27,28)13-14-6-8-16(19(23)11-14)21(26)25-15-7-9-18(22)17(12-15)20-5-3-4-10-24-20;20-15-7-5-12(10-14(15)17-3-1-2-8-22-17)23-19(26)13-6-4-11(9-16(13)21)18(25)24-27/h1-2,5-10,13-14H,3-4,11-12H2,(H,27,29);3-12,14H,13H2,1-2H3,(H,26,27);3-12H,2,13H2,1H3,(H,25,26);1-10,27H,(H,23,26)(H,24,25)
InChIKeyHXKSBEVARICBLU-UHFFFAOYSA-N
XLogP20.84
TPSA305.88 Ų
H-Bond Donors6
H-Bond Acceptors15
Rotatable Bonds20
Heavy Atoms116
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001755.31
LogP ≤ 520.84
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide?
The IUPAC name of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide (CID 158616251) is 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide.
What is the SMILES notation for 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide?
The canonical SMILES for 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide is CC(C)S(=O)(=O)Cc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.CCS(=O)(=O)Cc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(NO)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(C(=O)N2CCCC2)cc1Cl.
What is the InChIKey of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide?
The InChIKey is HXKSBEVARICBLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19Cl2N3O2.C22H20Cl2N2O3S.C21H18Cl2N2O3S.C19H13Cl2N3O3/c24-19-9-7-16(14-18(19)21-5-1-2-10-26-21)27-22(29)17-8-6-15(13-20(17)25)23(30)28-11-3-4-12-28;1-14(2)30(28,29)13-15-6-8-17(20(24)11-15)22(27)26-16-7-9-19(23)18(12-16)21-5-3-4-10-25-21;1-2-29(27,28)13-14-6-8-16(19(23)11-14)21(26)25-15-7-9-18(22)17(12-15)20-5-3-4-10-24-20;20-15-7-5-12(10-14(15)17-3-1-2-8-22-17)23-19(26)13-6-4-11(9-16(13)21)18(25)24-27/h1-2,5-10,13-14H,3-4,11-12H2,(H,27,29);3-12,14H,13H2,1-2H3,(H,26,27);3-12H,2,13H2,1H3,(H,25,26);1-10,27H,(H,23,26)(H,24,25).
What are the key properties of 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide?
2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide has a molecular weight of 1755.31 g/mol, XLogP of 20.84, 20 rotatable bonds, 6 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(ethylsulfonylmethyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(propan-2-ylsulfonylmethyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide is sourced from PubChem (CID 158616251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).