2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum

C34H22N3O2Pt- — CID 154590125

About 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum

2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum (PubChem CID 154590125) has the molecular formula C34H22N3O2Pt- and a molecular weight of 699.65 g/mol. Its IUPAC name is 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum
• PubChem CID: 154590125
• Molecular Formula: C34H22N3O2Pt-
• Molecular Weight: 699.65 g/mol
• Exact Mass: 699.14
• IUPAC Name: 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum
• SMILES: Oc1ccccc1-n1c2ccccc2c2ccc(-c3cc(-c4ccccc4)cc(Oc4[c-]cccc4)n3)nc21.[Pt]
• InChI: InChI=1S/C34H22N3O2.Pt/c38-32-18-10-9-17-31(32)37-30-16-8-7-15-26(30)27-19-20-28(36-34(27)37)29-21-24(23-11-3-1-4-12-23)22-33(35-29)39-25-13-5-2-6-14-25;/h1-13,15-22,38H;/q-1
• InChIKey: OFKRCFIYDMPQKX-UHFFFAOYSA-N
• XLogP: 8.20
• TPSA: 60.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	699.65
LogP ≤ 5	8.20
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum?

The IUPAC name of 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum (CID 154590125) is 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum.

What is the SMILES notation for 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum?

The canonical SMILES for 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum is Oc1ccccc1-n1c2ccccc2c2ccc(-c3cc(-c4ccccc4)cc(Oc4[c-]cccc4)n3)nc21.[Pt].

What is the InChIKey of 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum?

The InChIKey is OFKRCFIYDMPQKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22N3O2.Pt/c38-32-18-10-9-17-31(32)37-30-16-8-7-15-26(30)27-19-20-28(36-34(27)37)29-21-24(23-11-3-1-4-12-23)22-33(35-29)39-25-13-5-2-6-14-25;/h1-13,15-22,38H;/q-1;.

What are the key properties of 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum?

2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum has a molecular weight of 699.65 g/mol, XLogP of 8.20, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[6-(phenoxy)-4-phenyl-2-pyridinyl]pyrido[2,3-b]indol-9-yl]phenol;platinum is sourced from PubChem (CID 154590125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).