About pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide
pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide (PubChem CID 157364213) has the molecular formula C170H145N15O5Pt5
and a molecular weight of 3453.52 g/mol. Its IUPAC name is pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide.
Molecular Properties
| Compound Name | pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide |
| PubChem CID | 157364213 |
| Molecular Formula | C170H145N15O5Pt5 |
| Molecular Weight | 3453.52 g/mol |
| Exact Mass | 3450.98 |
| IUPAC Name | pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide |
| SMILES | CC(C)c1ccc(-n2c3[c-]c(-c4[c-]c(Oc5cc(C(C)C)ccn5)ccc4)ccc3c3ccccc32)nc1.CC(C)c1ccc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)C)ccn3)ccc2)nc1.CC(C)c1ccnc(-n2c3[c-]c(-c4[c-]c(Oc5ncccc5C(C)C)ccc4)ccc3c3ccccc32)c1.CC(C)c1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)C)ccn3)ccc2)c1.CC(C)c1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncccc3C(C)C)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2] |
| InChI | InChI=1S/5C34H29N3O.5Pt/c1-22(2)24-16-18-35-33(21-24)38-27-10-7-9-25(19-27)26-14-15-30-29-11-5-6-13-31(29)37(32(30)20-26)34-28(23(3)4)12-8-17-36-34;1-22(2)24-16-18-35-33(21-24)37-31-13-6-5-11-29(31)30-15-14-26(20-32(30)37)25-9-7-10-27(19-25)38-34-28(23(3)4)12-8-17-36-34;1-22(2)24-16-17-35-33(20-24)37-31-11-6-5-10-29(31)30-14-12-26(19-32(30)37)25-8-7-9-28(18-25)38-34-15-13-27(21-36-34)23(3)4;1-22(2)24-16-17-35-34(20-24)38-28-9-7-8-25(18-28)26-12-14-30-29-10-5-6-11-31(29)37(32(30)19-26)33-15-13-27(21-36-33)23(3)4;1-22(2)24-14-16-35-33(20-24)37-31-11-6-5-10-29(31)30-13-12-27(19-32(30)37)26-8-7-9-28(18-26)38-34-21-25(23(3)4)15-17-36-34;;;;;/h2*5-18,21-23H,1-4H3;3*5-17,20-23H,1-4H3;;;;;/q5*-2;5*+2 |
| InChIKey | WSDAJZAGTXHDHC-UHFFFAOYSA-N |
| XLogP | 44.39 |
| TPSA | 199.70 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 20 |
| Rotatable Bonds | 30 |
| Heavy Atoms | 195 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
| MW ≤ 500 | 3453.52 |
| LogP ≤ 5 | 44.39 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 20 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
|---|
Analyze pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide with MolForge
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Frequently Asked Questions
What is the IUPAC name of pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide?
The IUPAC name of pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide (CID 157364213) is pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide.
What is the SMILES notation for pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide?
The canonical SMILES for pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide is CC(C)c1ccc(-n2c3[c-]c(-c4[c-]c(Oc5cc(C(C)C)ccn5)ccc4)ccc3c3ccccc32)nc1.CC(C)c1ccc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)C)ccn3)ccc2)nc1.CC(C)c1ccnc(-n2c3[c-]c(-c4[c-]c(Oc5ncccc5C(C)C)ccc4)ccc3c3ccccc32)c1.CC(C)c1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)C)ccn3)ccc2)c1.CC(C)c1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncccc3C(C)C)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide?
The InChIKey is WSDAJZAGTXHDHC-UHFFFAOYSA-N. The full InChI is InChI=1S/5C34H29N3O.5Pt/c1-22(2)24-16-18-35-33(21-24)38-27-10-7-9-25(19-27)26-14-15-30-29-11-5-6-13-31(29)37(32(30)20-26)34-28(23(3)4)12-8-17-36-34;1-22(2)24-16-18-35-33(21-24)37-31-13-6-5-11-29(31)30-15-14-26(20-32(30)37)25-9-7-10-27(19-25)38-34-28(23(3)4)12-8-17-36-34;1-22(2)24-16-17-35-33(20-24)37-31-11-6-5-10-29(31)30-14-12-26(19-32(30)37)25-8-7-9-28(18-25)38-34-15-13-27(21-36-34)23(3)4;1-22(2)24-16-17-35-34(20-24)38-28-9-7-8-25(18-28)26-12-14-30-29-10-5-6-11-31(29)37(32(30)19-26)33-15-13-27(21-36-33)23(3)4;1-22(2)24-14-16-35-33(20-24)37-31-11-6-5-10-29(31)30-13-12-27(19-32(30)37)26-8-7-9-28(18-26)38-34-21-25(23(3)4)15-17-36-34;;;;;/h2*5-18,21-23H,1-4H3;3*5-17,20-23H,1-4H3;;;;;/q5*-2;5*+2.
What are the key properties of pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide?
pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide has a molecular weight of 3453.52 g/mol, XLogP of 44.39, 30 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for pentakis(platinum(2+));9-(3-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(3-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[(5-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(5-propan-2-yl-2-pyridinyl)-2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide is sourced from PubChem (CID 157364213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).