3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+))

C188H105N23O23P5Pd5Pt5+ — CID 159043140

About 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+))

3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+)) (PubChem CID 159043140) has the molecular formula C188H105N23O23P5Pd5Pt5+ and a molecular weight of 4716.41 g/mol. Its IUPAC name is 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+)).

Molecular Properties

• Compound Name: 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+))
• PubChem CID: 159043140
• Molecular Formula: C188H105N23O23P5Pd5Pt5+
• Molecular Weight: 4716.41 g/mol
• Exact Mass: 4710.99
• IUPAC Name: 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+))
• SMILES: C[P+]1(c2ncccn2)c2[c-]c(Oc3[c-]c(Oc4ccccn4)ccc3)ccc2-c2ccc(Oc3[c-]c(Oc4ccccn4)ccc3)[c-]c21.O=P1(c2ncccn2)c2[c-]c(Oc3[c-]c(Oc4ccccn4)ccc3)ccc2-c2ccc(Oc3[c-]c(Oc4ccccn4)ccc3)[c-]c21.O=P1(c2nccnn2)c2[c-]c(Oc3[c-]c(Oc4ccccn4)ccc3)ccc2-c2ccc(Oc3[c-]c(Oc4ccccn4)ccc3)[c-]c21.O=P1(c2ncncn2)c2[c-]c(Oc3[c-]c(Oc4ccccn4)ccc3)ccc2-c2ccc(Oc3[c-]c(Oc4ccccn4)ccc3)[c-]c21.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2p3-c2nccnn2)cccc1Oc1ccccn1
• InChI: InChI=1S/C39H24N4O4P.C38H21N4O5P.2C37H20N5O5P.C37H20N5O4P.5Pd.5Pt/c1-48(39-42-21-8-22-43-39)35-25-31(44-27-9-6-11-29(23-27)46-37-13-2-4-19-40-37)15-17-33(35)34-18-16-32(26-36(34)48)45-28-10-7-12-30(24-28)47-38-14-3-5-20-41-38;43-48(38-41-20-7-21-42-38)34-24-30(44-26-8-5-10-28(22-26)46-36-12-1-3-18-39-36)14-16-32(34)33-17-15-31(25-35(33)48)45-27-9-6-11-29(23-27)47-37-13-2-4-19-40-37;43-48(37-41-23-38-24-42-37)33-21-29(44-25-7-5-9-27(19-25)46-35-11-1-3-17-39-35)13-15-31(33)32-16-14-30(22-34(32)48)45-26-8-6-10-28(20-26)47-36-12-2-4-18-40-36;43-48(37-40-19-20-41-42-37)33-23-29(44-25-7-5-9-27(21-25)46-35-11-1-3-17-38-35)13-15-31(33)32-16-14-30(24-34(32)48)45-26-8-6-10-28(22-26)47-36-12-2-4-18-39-36;1-3-17-38-35(11-1)45-27-9-5-7-25(21-27)43-29-13-15-31-32-16-14-30(24-34(32)47(33(31)23-29)37-40-19-20-41-42-37)44-26-8-6-10-28(22-26)46-36-12-2-4-18-39-36;;;;;;;;;;/h2-22H,1H3;1-21H;1-18,23-24H;1-20H;1-20H;;;;;;;;;;/q-3;4*-4;10*+2
• InChIKey: WXNLUWHVSIVYBR-UHFFFAOYSA-N
• XLogP: 37.39
• TPSA: 532.28 Ų
• H-Bond Acceptors: 46
• Rotatable Bonds: 45
• Heavy Atoms: 249
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4716.41
LogP ≤ 5	37.39
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	46

Frequently Asked Questions

What is the IUPAC name of 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+))?

The IUPAC name of 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+)) (CID 159043140) is 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+)).

What is the SMILES notation for 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+))?

The canonical SMILES for 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+)) is C[P+]1(c2ncccn2)c2[c-]c(Oc3[c-]c(Oc4ccccn4)ccc3)ccc2-c2ccc(Oc3[c-]c(Oc4ccccn4)ccc3)[c-]c21.O=P1(c2ncccn2)c2[c-]c(Oc3[c-]c(Oc4ccccn4)ccc3)ccc2-c2ccc(Oc3[c-]c(Oc4ccccn4)ccc3)[c-]c21.O=P1(c2nccnn2)c2[c-]c(Oc3[c-]c(Oc4ccccn4)ccc3)ccc2-c2ccc(Oc3[c-]c(Oc4ccccn4)ccc3)[c-]c21.O=P1(c2ncncn2)c2[c-]c(Oc3[c-]c(Oc4ccccn4)ccc3)ccc2-c2ccc(Oc3[c-]c(Oc4ccccn4)ccc3)[c-]c21.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2p3-c2nccnn2)cccc1Oc1ccccn1.

What is the InChIKey of 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+))?

The InChIKey is WXNLUWHVSIVYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H24N4O4P.C38H21N4O5P.2C37H20N5O5P.C37H20N5O4P.5Pd.5Pt/c1-48(39-42-21-8-22-43-39)35-25-31(44-27-9-6-11-29(23-27)46-37-13-2-4-19-40-37)15-17-33(35)34-18-16-32(26-36(34)48)45-28-10-7-12-30(24-28)47-38-14-3-5-20-41-38;43-48(38-41-20-7-21-42-38)34-24-30(44-26-8-5-10-28(22-26)46-36-12-1-3-18-39-36)14-16-32(34)33-17-15-31(25-35(33)48)45-27-9-6-11-29(23-27)47-37-13-2-4-19-40-37;43-48(37-41-23-38-24-42-37)33-21-29(44-25-7-5-9-27(19-25)46-35-11-1-3-17-39-35)13-15-31(33)32-16-14-30(22-34(32)48)45-26-8-6-10-28(20-26)47-36-12-2-4-18-40-36;43-48(37-40-19-20-41-42-37)33-23-29(44-25-7-5-9-27(21-25)46-35-11-1-3-17-38-35)13-15-31(33)32-16-14-30(24-34(32)48)45-26-8-6-10-28(22-26)47-36-12-2-4-18-39-36;1-3-17-38-35(11-1)45-27-9-5-7-25(21-27)43-29-13-15-31-32-16-14-30(24-34(32)47(33(31)23-29)37-40-19-20-41-42-37)44-26-8-6-10-28(22-26)46-36-12-2-4-18-39-36;;;;;;;;;;/h2-22H,1H3;1-21H;1-18,23-24H;1-20H;1-20H;;;;;;;;;;/q-3;4*-4;10*+2.

What are the key properties of 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+))?

3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+)) has a molecular weight of 4716.41 g/mol, XLogP of 37.39, 45 rotatable bonds, 0 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindole-4,6-diid-5-yl]-1,2,4-triazine;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-pyrimidin-2-yl-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,2,4-triazin-3-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-5-(1,3,5-triazin-2-yl)-4,6-dihydrobenzo[b]phosphindole-4,6-diide 5-oxide;2-[5-methyl-3,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-4,6-dihydrobenzo[b]phosphindol-5-ium-4,6-diid-5-yl]pyrimidine;pentakis(palladium(2+));pentakis(platinum(2+)) is sourced from PubChem (CID 159043140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).