ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide

C153H165N11O8Pt4-6 — CID 159459452

About ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide

ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide (PubChem CID 159459452) has the molecular formula C153H165N11O8Pt4-6 and a molecular weight of 3066.38 g/mol. Its IUPAC name is ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide.

Molecular Properties

• Compound Name: ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide
• PubChem CID: 159459452
• Molecular Formula: C153H165N11O8Pt4-6
• Molecular Weight: 3066.38 g/mol
• Exact Mass: 3064.15
• IUPAC Name: ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.[Pt+2].[Pt+2].[Pt].[Pt].[c-]1c(Oc2[c-]c(-c3cccc4c3[N-]c3ccccc3C=C4)ccc2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)oc2cccnc23)cccc1N1c2ccccc2C=Cc2cccnc21.[c-]1c(Oc2ccccn2)ccc2oc3ccc(-c4cccc5c4[N-]c4ncccc4C=C5)[c-]c3c12.[c-]1c(Oc2ccccn2)ccc2oc3ccc(N4c5ccccc5C=Cc5cccnc54)[c-]c3c12
• InChI: InChI=1S/C31H19N2O2.C30H17N3O2.C30H16N3O2.C30H17N3O2.16C2H6.4Pt/c1-2-15-29-22(8-1)17-18-23-9-6-14-28(31(23)33-29)24-10-5-11-25(20-24)34-26-12-7-13-27(21-26)35-30-16-3-4-19-32-30;1-2-10-26-20(6-1)12-13-21-7-4-17-32-30(21)33(26)22-8-3-9-23(18-22)34-24-14-15-27-25(19-24)29-28(35-27)11-5-16-31-29;1-2-15-31-28(8-1)34-22-12-14-27-25(18-22)24-17-21(11-13-26(24)35-27)23-7-3-5-19-9-10-20-6-4-16-32-30(20)33-29(19)23;1-2-8-26-20(6-1)10-11-21-7-5-17-32-30(21)33(26)22-12-14-27-24(18-22)25-19-23(13-15-28(25)35-27)34-29-9-3-4-16-31-29;16*1-2;;;;/h1-19H;1-17H;1-16H;1-17H;16*1-2H3;;;;/q-3;-2;-3;-2;;;;;;;;;;;;;;;;;;;2*+2
• InChIKey: BDKQTQAEJXMWQK-UHFFFAOYSA-N
• XLogP: 48.86
• TPSA: 210.48 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 14
• Heavy Atoms: 176
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3066.38
LogP ≤ 5	48.86
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': 'stilbene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide?

The IUPAC name of ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide (CID 159459452) is ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide.

What is the SMILES notation for ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide?

The canonical SMILES for ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.[Pt+2].[Pt+2].[Pt].[Pt].[c-]1c(Oc2[c-]c(-c3cccc4c3[N-]c3ccccc3C=C4)ccc2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)oc2cccnc23)cccc1N1c2ccccc2C=Cc2cccnc21.[c-]1c(Oc2ccccn2)ccc2oc3ccc(-c4cccc5c4[N-]c4ncccc4C=C5)[c-]c3c12.[c-]1c(Oc2ccccn2)ccc2oc3ccc(N4c5ccccc5C=Cc5cccnc54)[c-]c3c12.

What is the InChIKey of ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide?

The InChIKey is BDKQTQAEJXMWQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H19N2O2.C30H17N3O2.C30H16N3O2.C30H17N3O2.16C2H6.4Pt/c1-2-15-29-22(8-1)17-18-23-9-6-14-28(31(23)33-29)24-10-5-11-25(20-24)34-26-12-7-13-27(21-26)35-30-16-3-4-19-32-30;1-2-10-26-20(6-1)12-13-21-7-4-17-32-30(21)33(26)22-8-3-9-23(18-22)34-24-14-15-27-25(19-24)29-28(35-27)11-5-16-31-29;1-2-15-31-28(8-1)34-22-12-14-27-25(18-22)24-17-21(11-13-26(24)35-27)23-7-3-5-19-9-10-20-6-4-16-32-30(20)33-29(19)23;1-2-8-26-20(6-1)10-11-21-7-5-17-32-30(21)33(26)22-12-14-27-24(18-22)25-19-23(13-15-28(25)35-27)34-29-9-3-4-16-31-29;16*1-2;;;;/h1-19H;1-17H;1-16H;1-17H;16*1-2H3;;;;/q-3;-2;-3;-2;;;;;;;;;;;;;;;;;;;2*+2.

What are the key properties of ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide?

ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide has a molecular weight of 3066.38 g/mol, XLogP of 48.86, 14 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for ethane;platinum;bis(platinum(2+));1-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]benzo[b][1]benzazepin-11-ide;11-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepine;10-(8-pyridin-2-yloxy-1,9-dihydrodibenzofuran-1,9-diid-2-yl)pyrido[2,3-b][1]benzazepin-11-ide;8-(3-pyrido[2,3-b][1]benzazepin-11-ylbenzene-2-id-1-yl)oxy-9H-[1]benzofuro[3,2-b]pyridin-9-ide is sourced from PubChem (CID 159459452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).