9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

C51H46N5OPt-3 — CID 176783188

About 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (PubChem CID 176783188) has the molecular formula C51H46N5OPt-3 and a molecular weight of 940.04 g/mol. Its IUPAC name is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• PubChem CID: 176783188
• Molecular Formula: C51H46N5OPt-3
• Molecular Weight: 940.04 g/mol
• Exact Mass: 939.34
• IUPAC Name: 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• SMILES: CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1N1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)ccc2)c2ccncc21.[Pt]
• InChI: InChI=1S/C51H46N5O.Pt/c1-33(2)43-26-36(35-14-9-8-10-15-35)27-44(34(3)4)50(43)55-32-54(46-23-24-52-31-48(46)55)38-16-13-17-39(29-38)57-40-20-21-42-41-18-11-12-19-45(41)56(47(42)30-40)49-28-37(22-25-53-49)51(5,6)7;/h8-28,31-34H,1-7H3;/q-3
• InChIKey: PWNPYXZOYYKCIB-UHFFFAOYSA-N
• XLogP: 13.58
• TPSA: 46.42 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 58
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	940.04
LogP ≤ 5	13.58
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (CID 176783188) is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The canonical SMILES for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1N1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)ccc2)c2ccncc21.[Pt].

What is the InChIKey of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The InChIKey is PWNPYXZOYYKCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H46N5O.Pt/c1-33(2)43-26-36(35-14-9-8-10-15-35)27-44(34(3)4)50(43)55-32-54(46-23-24-52-31-48(46)55)38-16-13-17-39(29-38)57-40-20-21-42-41-18-11-12-19-45(41)56(47(42)30-40)49-28-37(22-25-53-49)51(5,6)7;/h8-28,31-34H,1-7H3;/q-3;.

What are the key properties of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum has a molecular weight of 940.04 g/mol, XLogP of 13.58, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 176783188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).