9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

C53H55N4OPt-3 — CID 155651959

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

9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (PubChem CID 155651959) has the molecular formula C53H55N4OPt-3 and a molecular weight of 959.13 g/mol. Its IUPAC name is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-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-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• PubChem CID: 155651959
• Molecular Formula: C53H55N4OPt-3
• Molecular Weight: 959.13 g/mol
• Exact Mass: 958.40
• IUPAC Name: 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• SMILES: CC1=C(C)N(c2cccc(-c3c(C(C)C)cc(C(C)C)cc3C(C)C)c2)[CH-]N1c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)ccc1.[Pt]
• InChI: InChI=1S/C53H55N4O.Pt/c1-33(2)39-27-47(34(3)4)52(48(28-39)35(5)6)38-16-14-17-41(26-38)55-32-56(37(8)36(55)7)42-18-15-19-43(30-42)58-44-22-23-46-45-20-12-13-21-49(45)57(50(46)31-44)51-29-40(24-25-54-51)53(9,10)11;/h12-29,32-35H,1-11H3;/q-3
• InChIKey: HJXTYDZKZQIOHO-UHFFFAOYSA-N
• XLogP: 14.60
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 59
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	959.13
LogP ≤ 5	14.60
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 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-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-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (CID 155651959) is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-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-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-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-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is CC1=C(C)N(c2cccc(-c3c(C(C)C)cc(C(C)C)cc3C(C)C)c2)[CH-]N1c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)ccc1.[Pt].

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

The InChIKey is HJXTYDZKZQIOHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H55N4O.Pt/c1-33(2)39-27-47(34(3)4)52(48(28-39)35(5)6)38-16-14-17-41(26-38)55-32-56(37(8)36(55)7)42-18-15-19-43(30-42)58-44-22-23-46-45-20-12-13-21-49(45)57(50(46)31-44)51-29-40(24-25-54-51)53(9,10)11;/h12-29,32-35H,1-11H3;/q-3;.

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

9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum has a molecular weight of 959.13 g/mol, XLogP of 14.60, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-dimethyl-3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 155651959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).