2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+)

C37H26N2OPt — CID 140824186

IUPAC2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+)
SMILESCc1ccc2c(c1)C(c1cccc(-c3[c-]cccc3)n1)(c1cccc(-c3[c-]cccc3)n1)c1cc(C)ccc1O2.[Pt+2]
InChIInChI=1S/C37H26N2O.Pt/c1-25-19-21-33-29(23-25)37(30-24-26(2)20-22-34(30)40-33,35-17-9-15-31(38-35)27-11-5-3-6-12-27)36-18-10-16-32(39-36)28-13-7-4-8-14-28;/h3-11,13,15-24H,1-2H3;/q-2;+2
InChIKeyFLCCMCLVWNXSLS-UHFFFAOYSA-N
MW709.71 g/mol
LogP8.51
Rot. Bonds4

About 2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+)

2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+) (PubChem CID 140824186) has the molecular formula C37H26N2OPt and a molecular weight of 709.71 g/mol. Its IUPAC name is 2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+).

Molecular Properties

Compound Name2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+)
PubChem CID140824186
Molecular FormulaC37H26N2OPt
Molecular Weight709.71 g/mol
Exact Mass709.17
IUPAC Name2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+)
SMILESCc1ccc2c(c1)C(c1cccc(-c3[c-]cccc3)n1)(c1cccc(-c3[c-]cccc3)n1)c1cc(C)ccc1O2.[Pt+2]
InChIInChI=1S/C37H26N2O.Pt/c1-25-19-21-33-29(23-25)37(30-24-26(2)20-22-34(30)40-33,35-17-9-15-31(38-35)27-11-5-3-6-12-27)36-18-10-16-32(39-36)28-13-7-4-8-14-28;/h3-11,13,15-24H,1-2H3;/q-2;+2
InChIKeyFLCCMCLVWNXSLS-UHFFFAOYSA-N
XLogP8.51
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500709.71
LogP ≤ 58.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2,7-diphenyl-9-(6-phenyl-2-pyridinyl)thioxanthen-9-yl]-6-phenylpyridine;platinum(2+)
CID 140824206
chloronickel;2,6-di(phenyl)pyridine
CID 153499161
carbanide;bis(iridium);bis(2-phenylpyridine);2,7,9,9-tetramethylfluorene
CID 162045082
2-(4-phenylphenyl)-6-[9-[6-(4-phenylphenyl)-2-pyridinyl]xanthen-9-yl]pyridine
CID 140758618
2-(3-tert-butylbenzene-6-id-1-yl)-6-[9-[6-(3-tert-butylbenzene-6-id-1-yl)-2-pyridinyl]fluoren-9-yl]pyridine;2-(3,4-dimethylbenzene-6-id-1-yl)-6-[9-[6-(3,4-dimethylbenzene-6-id-1-yl)-2-pyridinyl]fluoren-9-yl]pyridine;platinum;bis(platinum(2+));2-pyridin-2-yl-6-[9-(6-pyridin-2-yl-2-pyridinyl)fluoren-9-yl]pyridine
CID 158029976
2-[9-(1H-indol-2-yl)-2,7-dimethylxanthen-9-yl]-1H-indole
CID 101124309
CID 140824257
CID 140824257
2-tert-butyl-5-[6-[9-[6-(6-tert-butyl-3-pyridinyl)-2-pyridinyl]xanthen-9-yl]-2-pyridinyl]pyridine;methane
CID 159322657
CID 162486024
CID 162486024
3-[6-[9-[6-(3-cyanophenyl)-2-pyridinyl]xanthen-9-yl]-2-pyridinyl]benzonitrile
CID 71261603
2,7-dimethylspiro[fluorene-9,9'-xanthene]
CID 58250911
nickel;2-[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]phenol
CID 153499066

Frequently Asked Questions

What is the IUPAC name of 2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+)?
The IUPAC name of 2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+) (CID 140824186) is 2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+).
What is the SMILES notation for 2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+)?
The canonical SMILES for 2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+) is Cc1ccc2c(c1)C(c1cccc(-c3[c-]cccc3)n1)(c1cccc(-c3[c-]cccc3)n1)c1cc(C)ccc1O2.[Pt+2].
What is the InChIKey of 2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+)?
The InChIKey is FLCCMCLVWNXSLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26N2O.Pt/c1-25-19-21-33-29(23-25)37(30-24-26(2)20-22-34(30)40-33,35-17-9-15-31(38-35)27-11-5-3-6-12-27)36-18-10-16-32(39-36)28-13-7-4-8-14-28;/h3-11,13,15-24H,1-2H3;/q-2;+2.
What are the key properties of 2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+)?
2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+) has a molecular weight of 709.71 g/mol, XLogP of 8.51, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,7-dimethyl-9-(6-phenyl-2-pyridinyl)xanthen-9-yl]-6-phenylpyridine;platinum(2+) is sourced from PubChem (CID 140824186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).