N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde

C100H124Br4Cl4F12N12O15S4Si2 — CID 159296122

About N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde

N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde (PubChem CID 159296122) has the molecular formula C100H124Br4Cl4F12N12O15S4Si2 and a molecular weight of 2608.00 g/mol. Its IUPAC name is N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde.

Molecular Properties

• Compound Name: N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde
• PubChem CID: 159296122
• Molecular Formula: C100H124Br4Cl4F12N12O15S4Si2
• Molecular Weight: 2608.00 g/mol
• Exact Mass: 2600.30
• IUPAC Name: N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde
• SMILES: C.C.C.C.COCN(c1cc(CBr)cnc1Br)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.COCc1cnc(Br)c(N(COC)S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1.COCc1cnc(C(O)c2c(C)cnc3c2ccn3[Si](C(C)C)(C(C)C)C(C)C)c(N(COC)S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1.Cc1cnc(Br)c(NS(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1.Cc1cnc2c(ccn2[Si](C(C)C)(C(C)C)C(C)C)c1C=O
• InChI: InChI=1S/C34H44ClF3N4O5SSi.C18H28N2OSi.C16H15BrClF3N2O4S.C15H12Br2ClF3N2O3S.C13H9BrClF3N2O2S.4CH4/c1-20(2)49(21(3)4,22(5)6)42-13-12-26-30(23(7)16-40-33(26)42)32(43)31-29(14-24(17-39-31)18-46-8)41(19-47-9)48(44,45)25-10-11-28(35)27(15-25)34(36,37)38;1-12(2)22(13(3)4,14(5)6)20-9-8-16-17(11-21)15(7)10-19-18(16)20;1-26-8-10-5-14(15(17)22-7-10)23(9-27-2)28(24,25)11-3-4-13(18)12(6-11)16(19,20)21;1-26-8-23(13-4-9(6-16)7-22-14(13)17)27(24,25)10-2-3-12(18)11(5-10)15(19,20)21;1-7-4-11(12(14)19-6-7)20-23(21,22)8-2-3-10(15)9(5-8)13(16,17)18;;;;/h10-17,20-22,32,43H,18-19H2,1-9H3;8-14H,1-7H3;3-7H,8-9H2,1-2H3;2-5,7H,6,8H2,1H3;2-6,20H,1H3;4*1H4
• InChIKey: LASZKKCJUSMWCY-UHFFFAOYSA-N
• XLogP: 30.49
• TPSA: 328.96 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 23
• Rotatable Bonds: 34
• Heavy Atoms: 153
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2608.00
LogP ≤ 5	30.49
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde?

The IUPAC name of N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde (CID 159296122) is N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde.

What is the SMILES notation for N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde?

The canonical SMILES for N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde is C.C.C.C.COCN(c1cc(CBr)cnc1Br)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.COCc1cnc(Br)c(N(COC)S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1.COCc1cnc(C(O)c2c(C)cnc3c2ccn3[Si](C(C)C)(C(C)C)C(C)C)c(N(COC)S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1.Cc1cnc(Br)c(NS(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1.Cc1cnc2c(ccn2[Si](C(C)C)(C(C)C)C(C)C)c1C=O.

What is the InChIKey of N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde?

The InChIKey is LASZKKCJUSMWCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H44ClF3N4O5SSi.C18H28N2OSi.C16H15BrClF3N2O4S.C15H12Br2ClF3N2O3S.C13H9BrClF3N2O2S.4CH4/c1-20(2)49(21(3)4,22(5)6)42-13-12-26-30(23(7)16-40-33(26)42)32(43)31-29(14-24(17-39-31)18-46-8)41(19-47-9)48(44,45)25-10-11-28(35)27(15-25)34(36,37)38;1-12(2)22(13(3)4,14(5)6)20-9-8-16-17(11-21)15(7)10-19-18(16)20;1-26-8-10-5-14(15(17)22-7-10)23(9-27-2)28(24,25)11-3-4-13(18)12(6-11)16(19,20)21;1-26-8-23(13-4-9(6-16)7-22-14(13)17)27(24,25)10-2-3-12(18)11(5-10)15(19,20)21;1-7-4-11(12(14)19-6-7)20-23(21,22)8-2-3-10(15)9(5-8)13(16,17)18;;;;/h10-17,20-22,32,43H,18-19H2,1-9H3;8-14H,1-7H3;3-7H,8-9H2,1-2H3;2-5,7H,6,8H2,1H3;2-6,20H,1H3;4*1H4.

What are the key properties of N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde?

N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde has a molecular weight of 2608.00 g/mol, XLogP of 30.49, 34 rotatable bonds, 2 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-bromo-5-(bromomethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-[2-bromo-5-(methoxymethyl)-3-pyridinyl]-4-chloro-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;N-(2-bromo-5-methyl-3-pyridinyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[2-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methyl]-5-(methoxymethyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide;methane;5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carbaldehyde is sourced from PubChem (CID 159296122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).