diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+)

C42H37N5OsP+ — CID 164705704

IUPACdiphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+)
SMILESCc1cc(N2C=CN(C)[CH-]2)[c-]c(N2C=CN(C)[CH-]2)c1.[Os+4].[c-]1ccccc1-c1ccc2cccc([PH+](c3ccccc3)c3ccccc3)c2n1
InChIInChI=1S/C27H19NP.C15H17N4.Os/c1-4-11-21(12-5-1)25-20-19-22-13-10-18-26(27(22)28-25)29(23-14-6-2-7-15-23)24-16-8-3-9-17-24;1-13-8-14(18-6-4-16(2)11-18)10-15(9-13)19-7-5-17(3)12-19;/h1-11,13-20H;4-9,11-12H,1-3H3;/q-1;-3;+4/p+1
InChIKeyPRFBCTGRTSYSRE-UHFFFAOYSA-O
MW833.00 g/mol
LogP7.67
Rot. Bonds6

About diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+)

diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+) (PubChem CID 164705704) has the molecular formula C42H37N5OsP+ and a molecular weight of 833.00 g/mol. Its IUPAC name is diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+).

Molecular Properties

Compound Namediphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+)
PubChem CID164705704
Molecular FormulaC42H37N5OsP+
Molecular Weight833.00 g/mol
Exact Mass834.24
IUPAC Namediphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+)
SMILESCc1cc(N2C=CN(C)[CH-]2)[c-]c(N2C=CN(C)[CH-]2)c1.[Os+4].[c-]1ccccc1-c1ccc2cccc([PH+](c3ccccc3)c3ccccc3)c2n1
InChIInChI=1S/C27H19NP.C15H17N4.Os/c1-4-11-21(12-5-1)25-20-19-22-13-10-18-26(27(22)28-25)29(23-14-6-2-7-15-23)24-16-8-3-9-17-24;1-13-8-14(18-6-4-16(2)11-18)10-15(9-13)19-7-5-17(3)12-19;/h1-11,13-20H;4-9,11-12H,1-3H3;/q-1;-3;+4/p+1
InChIKeyPRFBCTGRTSYSRE-UHFFFAOYSA-O
XLogP7.67
TPSA25.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500833.00
LogP ≤ 57.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1,3-di(phenyl)-2H-imidazol-2-ide;iridium;1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2H-imidazol-2-ide
CID 168830637
CID 164795970
CID 164795970
1-(4-bromobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide;iridium(3+);5-phenyl-2-phenylpyridine
CID 171745628
iridium;2-phenylquinoline;1-phenyl-5-(2,4,6-trimethylphenyl)pyrazole
CID 157261228
1-(3,5-dimethylbenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide;bis(iridium(3+));1-methyl-3-(1,2,3,5-tetrahydroinden-5-id-4-yl)-2H-imidazol-2-ide;bis(2-phenyl-1-[2,4,6-tri(propan-2-yl)phenyl]imidazole)
CID 162023142
1-methyl-3-[3-methyl-5-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2H-imidazol-2-ide;platinum(4+)
CID 164816533
tetrakis(1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole);bis(iridium);bis(2-(3-methyl-2H-imidazol-2-id-1-yl)-9-phenyl-3H-carbazol-3-ide)
CID 159178169
ethane;ethanol;iridium;1-methyl-3-phenyl-2H-imidazol-2-ide;pyridine
CID 162283599
carbanide;iridium;2-phenylquinoline;yttrium
CID 59824492
iridium;2-methyl-3-phenyl-6-phenylpyridine
CID 58435059
2,4-bis(5-methyl-2-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;iridium
CID 58261624
1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;iridium(3+);3-(3-methyl-2H-imidazol-2-id-1-yl)-9-phenyl-2H-carbazol-2-ide
CID 140810179

Frequently Asked Questions

What is the IUPAC name of diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+)?
The IUPAC name of diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+) (CID 164705704) is diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+).
What is the SMILES notation for diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+)?
The canonical SMILES for diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+) is Cc1cc(N2C=CN(C)[CH-]2)[c-]c(N2C=CN(C)[CH-]2)c1.[Os+4].[c-]1ccccc1-c1ccc2cccc([PH+](c3ccccc3)c3ccccc3)c2n1.
What is the InChIKey of diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+)?
The InChIKey is PRFBCTGRTSYSRE-UHFFFAOYSA-O. The full InChI is InChI=1S/C27H19NP.C15H17N4.Os/c1-4-11-21(12-5-1)25-20-19-22-13-10-18-26(27(22)28-25)29(23-14-6-2-7-15-23)24-16-8-3-9-17-24;1-13-8-14(18-6-4-16(2)11-18)10-15(9-13)19-7-5-17(3)12-19;/h1-11,13-20H;4-9,11-12H,1-3H3;/q-1;-3;+4/p+1.
What are the key properties of diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+)?
diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+) has a molecular weight of 833.00 g/mol, XLogP of 7.67, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(2-phenylquinolin-8-yl)phosphanium;1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide;osmium(4+) is sourced from PubChem (CID 164705704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).