chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum

C33H21ClN3O2Pt2-6 — CID 168758477

About chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum

chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum (PubChem CID 168758477) has the molecular formula C33H21ClN3O2Pt2-6 and a molecular weight of 917.16 g/mol. Its IUPAC name is chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum.

Molecular Properties

• Compound Name: chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum
• PubChem CID: 168758477
• Molecular Formula: C33H21ClN3O2Pt2-6
• Molecular Weight: 917.16 g/mol
• Exact Mass: 916.07
• IUPAC Name: chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum
• SMILES: CN1C=CN(c2[c-]c(Oc3[c-]c(-c4cc(-c5[c-]c(Oc6[c-]cccc6)ccc5)[c-]cn4)ccc3)ccc2)[CH-]1.Cl[Pt].[Pt]
• InChI: InChI=1S/C33H21N3O2.ClH.2Pt/c1-35-18-19-36(24-35)28-10-7-15-32(23-28)38-31-14-6-9-27(21-31)33-22-26(16-17-34-33)25-8-5-13-30(20-25)37-29-11-3-2-4-12-29;;;/h2-11,13-15,17-19,22,24H,1H3;1H;;/q-6;;;+1/p-1
• InChIKey: KRCXQENNQDYKKI-UHFFFAOYSA-M
• XLogP: 8.03
• TPSA: 37.83 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 41
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	917.16
LogP ≤ 5	8.03
H-Bond Donors ≤ 5	0
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 chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum?

The IUPAC name of chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum (CID 168758477) is chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum.

What is the SMILES notation for chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum?

The canonical SMILES for chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum is CN1C=CN(c2[c-]c(Oc3[c-]c(-c4cc(-c5[c-]c(Oc6[c-]cccc6)ccc5)[c-]cn4)ccc3)ccc2)[CH-]1.Cl[Pt].[Pt].

What is the InChIKey of chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum?

The InChIKey is KRCXQENNQDYKKI-UHFFFAOYSA-M. The full InChI is InChI=1S/C33H21N3O2.ClH.2Pt/c1-35-18-19-36(24-35)28-10-7-15-32(23-28)38-31-14-6-9-27(21-31)33-22-26(16-17-34-33)25-8-5-13-30(20-25)37-29-11-3-2-4-12-29;;;/h2-11,13-15,17-19,22,24H,1H3;1H;;/q-6;;;+1/p-1.

What are the key properties of chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum?

chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum has a molecular weight of 917.16 g/mol, XLogP of 8.03, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for chloroplatinum;6-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-4-[3-(phenoxy)benzene-2-id-1-yl]-3H-pyridin-3-ide;platinum is sourced from PubChem (CID 168758477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).