2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum

C152H98N16O10Pt5S4 — CID 160810686

IUPAC2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum
SMILESOc1cc(-c2ccccc2)sc1-c1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(-c4sc(-c5ccccc5)cc4O)nc3c2n1.Oc1cccnc1-c1ccc2ccc3ccc(-c4ncccc4O)nc3c2n1.Oc1cnccc1-c1ccc2ccc3ccc(-c4ccncc4O)nc3c2n1.Oc1cnccc1-c1cccc(-c2cccc(-c3ccncc3O)n2)n1.Oc1sc(-c2ccccc2)cc1-c1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(-c4cc(-c5ccccc5)sc4O)nc3c2n1.[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C44H28N2O2S2.2C22H14N4O2.C20H14N4O2.5Pt/c47-43-35(25-39(49-43)29-17-9-3-10-18-29)37-23-33(27-13-5-1-6-14-27)31-21-22-32-34(28-15-7-2-8-16-28)24-38(46-42(32)41(31)45-37)36-26-40(50-44(36)48)30-19-11-4-12-20-30;47-37-25-39(29-17-9-3-10-18-29)49-43(37)35-23-33(27-13-5-1-6-14-27)31-21-22-32-34(28-15-7-2-8-16-28)24-36(46-42(32)41(31)45-35)44-38(48)26-40(50-44)30-19-11-4-12-20-30;27-17-3-1-11-23-21(17)15-9-7-13-5-6-14-8-10-16(26-20(14)19(13)25-15)22-18(28)4-2-12-24-22;27-19-11-23-9-7-15(19)17-5-3-13-1-2-14-4-6-18(26-22(14)21(13)25-17)16-8-10-24-12-20(16)28;25-19-11-21-9-7-13(19)15-3-1-5-17(23-15)18-6-2-4-16(24-18)14-8-10-22-12-20(14)26;;;;;/h2*1-26,47-48H;2*1-12,27-28H;1-12,25-26H;;;;;
InChIKeyNZOUSHCIVVDNRD-UHFFFAOYSA-N
MW3412.22 g/mol
LogP36.94
Rot. Bonds19

About 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum

2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum (PubChem CID 160810686) has the molecular formula C152H98N16O10Pt5S4 and a molecular weight of 3412.22 g/mol. Its IUPAC name is 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum.

Molecular Properties

Compound Name2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum
PubChem CID160810686
Molecular FormulaC152H98N16O10Pt5S4
Molecular Weight3412.22 g/mol
Exact Mass3409.48
IUPAC Name2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum
SMILESOc1cc(-c2ccccc2)sc1-c1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(-c4sc(-c5ccccc5)cc4O)nc3c2n1.Oc1cccnc1-c1ccc2ccc3ccc(-c4ncccc4O)nc3c2n1.Oc1cnccc1-c1ccc2ccc3ccc(-c4ccncc4O)nc3c2n1.Oc1cnccc1-c1cccc(-c2cccc(-c3ccncc3O)n2)n1.Oc1sc(-c2ccccc2)cc1-c1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(-c4cc(-c5ccccc5)sc4O)nc3c2n1.[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C44H28N2O2S2.2C22H14N4O2.C20H14N4O2.5Pt/c47-43-35(25-39(49-43)29-17-9-3-10-18-29)37-23-33(27-13-5-1-6-14-27)31-21-22-32-34(28-15-7-2-8-16-28)24-38(46-42(32)41(31)45-37)36-26-40(50-44(36)48)30-19-11-4-12-20-30;47-37-25-39(29-17-9-3-10-18-29)49-43(37)35-23-33(27-13-5-1-6-14-27)31-21-22-32-34(28-15-7-2-8-16-28)24-36(46-42(32)41(31)45-35)44-38(48)26-40(50-44)30-19-11-4-12-20-30;27-17-3-1-11-23-21(17)15-9-7-13-5-6-14-8-10-16(26-20(14)19(13)25-15)22-18(28)4-2-12-24-22;27-19-11-23-9-7-15(19)17-5-3-13-1-2-14-4-6-18(26-22(14)21(13)25-17)16-8-10-24-12-20(16)28;25-19-11-21-9-7-13(19)15-3-1-5-17(23-15)18-6-2-4-16(24-18)14-8-10-22-12-20(14)26;;;;;/h2*1-26,47-48H;2*1-12,27-28H;1-12,25-26H;;;;;
InChIKeyNZOUSHCIVVDNRD-UHFFFAOYSA-N
XLogP36.94
TPSA408.54 Ų
H-Bond Donors10
H-Bond Acceptors30
Rotatable Bonds19
Heavy Atoms187
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003412.22
LogP ≤ 536.94
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiophene_hydroxy(28)', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum?
The IUPAC name of 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum (CID 160810686) is 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum.
What is the SMILES notation for 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum?
The canonical SMILES for 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum is Oc1cc(-c2ccccc2)sc1-c1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(-c4sc(-c5ccccc5)cc4O)nc3c2n1.Oc1cccnc1-c1ccc2ccc3ccc(-c4ncccc4O)nc3c2n1.Oc1cnccc1-c1ccc2ccc3ccc(-c4ccncc4O)nc3c2n1.Oc1cnccc1-c1cccc(-c2cccc(-c3ccncc3O)n2)n1.Oc1sc(-c2ccccc2)cc1-c1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(-c4cc(-c5ccccc5)sc4O)nc3c2n1.[Pt].[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum?
The InChIKey is NZOUSHCIVVDNRD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C44H28N2O2S2.2C22H14N4O2.C20H14N4O2.5Pt/c47-43-35(25-39(49-43)29-17-9-3-10-18-29)37-23-33(27-13-5-1-6-14-27)31-21-22-32-34(28-15-7-2-8-16-28)24-38(46-42(32)41(31)45-37)36-26-40(50-44(36)48)30-19-11-4-12-20-30;47-37-25-39(29-17-9-3-10-18-29)49-43(37)35-23-33(27-13-5-1-6-14-27)31-21-22-32-34(28-15-7-2-8-16-28)24-36(46-42(32)41(31)45-35)44-38(48)26-40(50-44)30-19-11-4-12-20-30;27-17-3-1-11-23-21(17)15-9-7-13-5-6-14-8-10-16(26-20(14)19(13)25-15)22-18(28)4-2-12-24-22;27-19-11-23-9-7-15(19)17-5-3-13-1-2-14-4-6-18(26-22(14)21(13)25-17)16-8-10-24-12-20(16)28;25-19-11-21-9-7-13(19)15-3-1-5-17(23-15)18-6-2-4-16(24-18)14-8-10-22-12-20(14)26;;;;;/h2*1-26,47-48H;2*1-12,27-28H;1-12,25-26H;;;;;.
What are the key properties of 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum?
2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum has a molecular weight of 3412.22 g/mol, XLogP of 36.94, 19 rotatable bonds, 10 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-(3-hydroxy-5-phenylthiophen-2-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-3-ol;3-[9-(2-hydroxy-5-phenylthiophen-3-yl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-5-phenylthiophen-2-ol;2-[9-(3-hydroxy-2-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[9-(3-hydroxy-4-pyridinyl)-1,10-phenanthrolin-2-yl]pyridin-3-ol;4-[6-[6-(3-hydroxy-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridin-3-ol;platinum is sourced from PubChem (CID 160810686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).