15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)

C41H36N2O2Pt — CID 164939669

About 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)

15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+) (PubChem CID 164939669) has the molecular formula C41H36N2O2Pt and a molecular weight of 783.83 g/mol. Its IUPAC name is 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+).

Molecular Properties

• Compound Name: 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)
• PubChem CID: 164939669
• Molecular Formula: C41H36N2O2Pt
• Molecular Weight: 783.83 g/mol
• Exact Mass: 783.24
• IUPAC Name: 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)
• SMILES: CC(C)(C)Cc1ccc2c(ccc3c4ccnc(-c5[c-]c(Oc6[c-]c(-c7cc(C(C)(C)C)ccn7)ccc6)ccc5)c4oc23)c1.[Pt+2]
• InChI: InChI=1S/C41H36N2O2.Pt/c1-40(2,3)25-26-13-15-33-27(21-26)14-16-34-35-18-20-43-37(39(35)45-38(33)34)29-10-8-12-32(23-29)44-31-11-7-9-28(22-31)36-24-30(17-19-42-36)41(4,5)6;/h7-21,24H,25H2,1-6H3;/q-2;+2
• InChIKey: QZAUARPEYQADBX-UHFFFAOYSA-N
• XLogP: 11.14
• TPSA: 48.15 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 46
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	783.83
LogP ≤ 5	11.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)?

The IUPAC name of 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+) (CID 164939669) is 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+).

What is the SMILES notation for 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)?

The canonical SMILES for 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+) is CC(C)(C)Cc1ccc2c(ccc3c4ccnc(-c5[c-]c(Oc6[c-]c(-c7cc(C(C)(C)C)ccn7)ccc6)ccc5)c4oc23)c1.[Pt+2].

What is the InChIKey of 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)?

The InChIKey is QZAUARPEYQADBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H36N2O2.Pt/c1-40(2,3)25-26-13-15-33-27(21-26)14-16-34-35-18-20-43-37(39(35)45-38(33)34)29-10-8-12-32(23-29)44-31-11-7-9-28(22-31)36-24-30(17-19-42-36)41(4,5)6;/h7-21,24H,25H2,1-6H3;/q-2;+2.

What are the key properties of 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)?

15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+) has a molecular weight of 783.83 g/mol, XLogP of 11.14, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+) is sourced from PubChem (CID 164939669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).