bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine)

C244H184Br2Cl5F12N25Ni10-5 — CID 157319597

IUPACbis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine)
SMILESBrc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Brc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.CC(C)(C)c1cc(-c2[c-]cccc2)nc(-c2ccccn2)c1.CC(C)(C)c1cc(-c2[c-]cccc2)nc(-c2ccccn2)c1.Cc1c[c-]c(-c2cc(C(C)(C)C)cc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cc1c[c-]c(-c2cc(C(C)(C)C)cc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cc1c[c-]c(-c2cccc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cc1c[c-]c(-c2cccc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cl[Ni].Cl[Ni].Cl[Ni].Cl[Ni].Cl[Ni].[Ni+2].[Ni+2].[Ni+2].[Ni+2].[Ni+2].[c-]1ccccc1-c1cccc(-c2ccccn2)n1.[c-]1ccccc1-c1cccc(-c2ccccn2)n1.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12
InChIInChI=1S/2C22H20F3N2.2C20H19N2.2C18H12F3N2.2C16H10BrN2.2C16H11N2.5C12H8N.5ClH.10Ni/c2*1-14-5-7-15(8-6-14)19-11-17(21(2,3)4)12-20(27-19)18-10-9-16(13-26-18)22(23,24)25;2*1-20(2,3)16-13-18(15-9-5-4-6-10-15)22-19(14-16)17-11-7-8-12-21-17;2*1-12-5-7-13(8-6-12)15-3-2-4-17(23-15)16-10-9-14(11-22-16)18(19,20)21;2*17-16-11-5-10-15(19-16)14-9-4-8-13(18-14)12-6-2-1-3-7-12;2*1-2-7-13(8-3-1)14-10-6-11-16(18-14)15-9-4-5-12-17-15;5*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;;;;;;;;;;;;;;;/h2*5-7,9-13H,1-4H3;2*4-9,11-14H,1-3H3;2*2-7,9-11H,1H3;2*1-6,8-11H;2*1-7,9-12H;5*1-8H;5*1H;;;;;;;;;;/q15*-1;;;;;;5*+1;5*+2/p-5
InChIKeyTUULXQVWBSWNPH-UHFFFAOYSA-I
MW4618.31 g/mol
LogP66.31
Rot. Bonds20

About bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine)

bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine) (PubChem CID 157319597) has the molecular formula C244H184Br2Cl5F12N25Ni10-5 and a molecular weight of 4618.31 g/mol. Its IUPAC name is bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine).

Molecular Properties

Compound Namebis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine)
PubChem CID157319597
Molecular FormulaC244H184Br2Cl5F12N25Ni10-5
Molecular Weight4618.31 g/mol
Exact Mass4603.53
IUPAC Namebis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine)
SMILESBrc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Brc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.CC(C)(C)c1cc(-c2[c-]cccc2)nc(-c2ccccn2)c1.CC(C)(C)c1cc(-c2[c-]cccc2)nc(-c2ccccn2)c1.Cc1c[c-]c(-c2cc(C(C)(C)C)cc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cc1c[c-]c(-c2cc(C(C)(C)C)cc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cc1c[c-]c(-c2cccc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cc1c[c-]c(-c2cccc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cl[Ni].Cl[Ni].Cl[Ni].Cl[Ni].Cl[Ni].[Ni+2].[Ni+2].[Ni+2].[Ni+2].[Ni+2].[c-]1ccccc1-c1cccc(-c2ccccn2)n1.[c-]1ccccc1-c1cccc(-c2ccccn2)n1.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12
InChIInChI=1S/2C22H20F3N2.2C20H19N2.2C18H12F3N2.2C16H10BrN2.2C16H11N2.5C12H8N.5ClH.10Ni/c2*1-14-5-7-15(8-6-14)19-11-17(21(2,3)4)12-20(27-19)18-10-9-16(13-26-18)22(23,24)25;2*1-20(2,3)16-13-18(15-9-5-4-6-10-15)22-19(14-16)17-11-7-8-12-21-17;2*1-12-5-7-13(8-6-12)15-3-2-4-17(23-15)16-10-9-14(11-22-16)18(19,20)21;2*17-16-11-5-10-15(19-16)14-9-4-8-13(18-14)12-6-2-1-3-7-12;2*1-2-7-13(8-3-1)14-10-6-11-16(18-14)15-9-4-5-12-17-15;5*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;;;;;;;;;;;;;;;/h2*5-7,9-13H,1-4H3;2*4-9,11-14H,1-3H3;2*2-7,9-11H,1H3;2*1-6,8-11H;2*1-7,9-12H;5*1-8H;5*1H;;;;;;;;;;/q15*-1;;;;;;5*+1;5*+2/p-5
InChIKeyTUULXQVWBSWNPH-UHFFFAOYSA-I
XLogP66.31
TPSA328.30 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds20
Heavy Atoms298
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004618.31
LogP ≤ 566.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine) with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine)?
The IUPAC name of bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine) (CID 157319597) is bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine).
What is the SMILES notation for bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine)?
The canonical SMILES for bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine) is Brc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Brc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.CC(C)(C)c1cc(-c2[c-]cccc2)nc(-c2ccccn2)c1.CC(C)(C)c1cc(-c2[c-]cccc2)nc(-c2ccccn2)c1.Cc1c[c-]c(-c2cc(C(C)(C)C)cc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cc1c[c-]c(-c2cc(C(C)(C)C)cc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cc1c[c-]c(-c2cccc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cc1c[c-]c(-c2cccc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cl[Ni].Cl[Ni].Cl[Ni].Cl[Ni].Cl[Ni].[Ni+2].[Ni+2].[Ni+2].[Ni+2].[Ni+2].[c-]1ccccc1-c1cccc(-c2ccccn2)n1.[c-]1ccccc1-c1cccc(-c2ccccn2)n1.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.
What is the InChIKey of bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine)?
The InChIKey is TUULXQVWBSWNPH-UHFFFAOYSA-I. The full InChI is InChI=1S/2C22H20F3N2.2C20H19N2.2C18H12F3N2.2C16H10BrN2.2C16H11N2.5C12H8N.5ClH.10Ni/c2*1-14-5-7-15(8-6-14)19-11-17(21(2,3)4)12-20(27-19)18-10-9-16(13-26-18)22(23,24)25;2*1-20(2,3)16-13-18(15-9-5-4-6-10-15)22-19(14-16)17-11-7-8-12-21-17;2*1-12-5-7-13(8-6-12)15-3-2-4-17(23-15)16-10-9-14(11-22-16)18(19,20)21;2*17-16-11-5-10-15(19-16)14-9-4-8-13(18-14)12-6-2-1-3-7-12;2*1-2-7-13(8-3-1)14-10-6-11-16(18-14)15-9-4-5-12-17-15;5*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;;;;;;;;;;;;;;;/h2*5-7,9-13H,1-4H3;2*4-9,11-14H,1-3H3;2*2-7,9-11H,1H3;2*1-6,8-11H;2*1-7,9-12H;5*1-8H;5*1H;;;;;;;;;;/q15*-1;;;;;;5*+1;5*+2/p-5.
What are the key properties of bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine)?
bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine) has a molecular weight of 4618.31 g/mol, XLogP of 66.31, 20 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);bis(4-tert-butyl-2-phenyl-6-pyridin-2-ylpyridine);pentakis(carbazol-9-ide);chloronickel;bis(2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine);pentakis(nickel(2+));bis(2-phenyl-6-pyridin-2-ylpyridine) is sourced from PubChem (CID 157319597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).