4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+))

C₁₅₅H₁₀₈BF₈N₁₁O₆P₄Pt₅ — CID 161339515

About 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+))

4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+)) (PubChem CID 161339515) has the molecular formula C₁₅₅H₁₀₈BF₈N₁₁O₆P₄Pt₅ and a molecular weight of 3484.73 g/mol. Its IUPAC name is 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+)).

Molecular Properties

• Compound Name: 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+))
• PubChem CID: 161339515
• Molecular Formula: C₁₅₅H₁₀₈BF₈N₁₁O₆P₄Pt₅
• Molecular Weight: 3484.73 g/mol
• Exact Mass: 3482.58
• IUPAC Name: 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+))
• SMILES: COc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3cc(F)ccc3p4-c3ccccn3)cc(F)c2)c1.Cc1cc(Oc2cc(N(C)C)ccn2)[c-]c(-c2[c-]c3c(cc2)c2cc(C)ccc2p3-c2ccccn2)c1.Cc1cc(Oc2ccccn2)[c-]c(-c2[c-]c3c(cc2)-c2cc(C)ccc2B3c2cc(C)ccn2)c1.Cc1ccc2c(c1)c1ccc(-c3[c-]c(Oc4cc(C(C)(C)C)ccn4)cc(C(F)(F)F)c3)[c-]c1p2-c1ccccn1.[2H]c1cc(Oc2cc(C(F)(F)F)ccn2)[c-]c(-c2[c-]c3c(cc2)c2cc([2H])ccc2p3-c2ccccn2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
• InChI: InChI=1S/C34H26F3N2OP.C32H26N3OP.C31H23BN2O.C29H16F3N2OP.C29H17F2N2O2P.5Pt/c1-21-8-11-29-28(15-21)27-10-9-22(18-30(27)41(29)32-7-5-6-13-39-32)23-16-25(34(35,36)37)19-26(17-23)40-31-20-24(12-14-38-31)33(2,3)4;1-21-8-11-29-28(17-21)27-10-9-23(19-30(27)37(29)32-7-5-6-13-34-32)24-15-22(2)16-26(18-24)36-31-20-25(35(3)4)12-14-33-31;1-20-7-10-28-27(16-20)26-9-8-23(19-29(26)32(28)30-17-21(2)11-13-33-30)24-14-22(3)15-25(18-24)35-31-6-4-5-12-34-31;30-29(31,32)21-13-15-33-27(18-21)35-22-7-5-6-19(16-22)20-11-12-24-23-8-1-2-9-25(23)36(26(24)17-20)28-10-3-4-14-34-28;1-34-22-9-11-32-28(17-22)35-23-13-19(12-21(31)15-23)18-5-7-24-25-16-20(30)6-8-26(25)36(27(24)14-18)29-4-2-3-10-33-29;;;;;/h5-16,19-20H,1-4H3;5-17,20H,1-4H3;4-17H,1-3H3;1-15,18H;2-12,15-17H,1H3;;;;;/q5*-2;5*+2/i;;;1D,5D
• InChIKey: ZXFROPWZBOTFKY-QGGDQQTCSA-N
• XLogP: 40.83
• TPSA: 187.52 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 22
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3484.73
LogP ≤ 5	40.83
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+))?

The IUPAC name of 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+)) (CID 161339515) is 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+)).

What is the SMILES notation for 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+))?

The canonical SMILES for 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+)) is COc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3cc(F)ccc3p4-c3ccccn3)cc(F)c2)c1.Cc1cc(Oc2cc(N(C)C)ccn2)[c-]c(-c2[c-]c3c(cc2)c2cc(C)ccc2p3-c2ccccn2)c1.Cc1cc(Oc2ccccn2)[c-]c(-c2[c-]c3c(cc2)-c2cc(C)ccc2B3c2cc(C)ccn2)c1.Cc1ccc2c(c1)c1ccc(-c3[c-]c(Oc4cc(C(C)(C)C)ccn4)cc(C(F)(F)F)c3)[c-]c1p2-c1ccccn1.[2H]c1cc(Oc2cc(C(F)(F)F)ccn2)[c-]c(-c2[c-]c3c(cc2)c2cc([2H])ccc2p3-c2ccccn2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].

What is the InChIKey of 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+))?

The InChIKey is ZXFROPWZBOTFKY-QGGDQQTCSA-N. The full InChI is InChI=1S/C34H26F3N2OP.C32H26N3OP.C31H23BN2O.C29H16F3N2OP.C29H17F2N2O2P.5Pt/c1-21-8-11-29-28(15-21)27-10-9-22(18-30(27)41(29)32-7-5-6-13-39-32)23-16-25(34(35,36)37)19-26(17-23)40-31-20-24(12-14-38-31)33(2,3)4;1-21-8-11-29-28(17-21)27-10-9-23(19-30(27)37(29)32-7-5-6-13-34-32)24-15-22(2)16-26(18-24)36-31-20-25(35(3)4)12-14-33-31;1-20-7-10-28-27(16-20)26-9-8-23(19-29(26)32(28)30-17-21(2)11-13-33-30)24-14-22(3)15-25(18-24)35-31-6-4-5-12-34-31;30-29(31,32)21-13-15-33-27(18-21)35-22-7-5-6-19(16-22)20-11-12-24-23-8-1-2-9-25(23)36(26(24)17-20)28-10-3-4-14-34-28;1-34-22-9-11-32-28(17-22)35-23-13-19(12-21(31)15-23)18-5-7-24-25-16-20(30)6-8-26(25)36(27(24)14-18)29-4-2-3-10-33-29;;;;;/h5-16,19-20H,1-4H3;5-17,20H,1-4H3;4-17H,1-3H3;1-15,18H;2-12,15-17H,1H3;;;;;/q5*-2;5*+2/i;;;1D,5D;;;;;;.

What are the key properties of 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+))?

4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+)) has a molecular weight of 3484.73 g/mol, XLogP of 40.83, 22 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-2-[3-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]oxypyridine;2-[3-deuterio-5-(8-deuterio-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-(trifluoromethyl)pyridine;N,N-dimethyl-2-[3-methyl-5-(8-methyl-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxypyridin-4-amine;2-[3-fluoro-5-(8-fluoro-5-pyridin-2-yl-4H-benzo[b]phosphindol-4-id-3-yl)benzene-6-id-1-yl]oxy-4-methoxypyridine;4-methyl-2-[8-methyl-3-(3-methyl-5-pyridin-2-yloxybenzene-6-id-1-yl)-4H-benzo[b][1]benzoborol-4-id-5-yl]pyridine;pentakis(platinum(2+)) is sourced from PubChem (CID 161339515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 161339515 — identifiers, structure, computed properties (public domain)

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