10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum

C59H42F3N4OPtTe-3 — CID 168840824

IUPAC10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum
SMILESCC(C)(C)c1ccnc(N2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6c(-c7ccccc7)cccc6-c6cccc(-c7ccccc7)c6)c6ccccc65)ccc4)ccc3[Te]c3ccc(C(F)(F)F)cc32)c1.[Pt]
InChIInChI=1S/C59H42F3N4OTe.Pt/c1-58(2,3)43-31-32-63-56(35-43)66-52-34-44(59(60,61)62)27-29-54(52)68-55-30-28-47(37-53(55)66)67-46-22-13-21-45(36-46)64-38-65(51-26-11-10-25-50(51)64)57-48(40-17-8-5-9-18-40)23-14-24-49(57)42-20-12-19-41(33-42)39-15-6-4-7-16-39;/h4-35,38H,1-3H3;/q-3;
InChIKeySZTUKYJBJLVNEY-UHFFFAOYSA-N
MW1202.68 g/mol
LogP14.64
Rot. Bonds8

About 10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum

10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum (PubChem CID 168840824) has the molecular formula C59H42F3N4OPtTe-3 and a molecular weight of 1202.68 g/mol. Its IUPAC name is 10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum.

Molecular Properties

Compound Name10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum
PubChem CID168840824
Molecular FormulaC59H42F3N4OPtTe-3
Molecular Weight1202.68 g/mol
Exact Mass1204.20
IUPAC Name10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum
SMILESCC(C)(C)c1ccnc(N2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6c(-c7ccccc7)cccc6-c6cccc(-c7ccccc7)c6)c6ccccc65)ccc4)ccc3[Te]c3ccc(C(F)(F)F)cc32)c1.[Pt]
InChIInChI=1S/C59H42F3N4OTe.Pt/c1-58(2,3)43-31-32-63-56(35-43)66-52-34-44(59(60,61)62)27-29-54(52)68-55-30-28-47(37-53(55)66)67-46-22-13-21-45(36-46)64-38-65(51-26-11-10-25-50(51)64)57-48(40-17-8-5-9-18-40)23-14-24-49(57)42-20-12-19-41(33-42)39-15-6-4-7-16-39;/h4-35,38H,1-3H3;/q-3;
InChIKeySZTUKYJBJLVNEY-UHFFFAOYSA-N
XLogP14.64
TPSA31.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms69
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001202.68
LogP ≤ 514.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
CID 177082962
CID 176782986
CID 176782986
10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenotellurazin-1-ide;platinum
CID 168840657
3-[3-[3-[2-(4-tert-butylphenyl)-6-phenylphenyl]-6-phenyl-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,4-b][1,4]benzoselenazin-4-ide;platinum
CID 168840839
CID 176783451
CID 176783451
CID 176783679
CID 176783679
2-[3-[3-(2-tert-butyl-6-phenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
CID 153490740
CID 176783514
CID 176783514
9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,5-ditert-butylphenyl)-4-phenyl-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-6-phenyl-1H-carbazol-1-ide;platinum
CID 168761429
6-(4-tert-butylphenyl)-2-[3-[3-[2-(3-tert-butylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
CID 170780405
3-[3-[3-[2,6-bis(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-12,12-diphenyl-4H-indeno[1,2-c]carbazol-4-ide;platinum
CID 170677141
CID 176843870
CID 176843870

Frequently Asked Questions

What is the IUPAC name of 10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum?
The IUPAC name of 10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum (CID 168840824) is 10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum.
What is the SMILES notation for 10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum?
The canonical SMILES for 10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum is CC(C)(C)c1ccnc(N2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6c(-c7ccccc7)cccc6-c6cccc(-c7ccccc7)c6)c6ccccc65)ccc4)ccc3[Te]c3ccc(C(F)(F)F)cc32)c1.[Pt].
What is the InChIKey of 10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum?
The InChIKey is SZTUKYJBJLVNEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H42F3N4OTe.Pt/c1-58(2,3)43-31-32-63-56(35-43)66-52-34-44(59(60,61)62)27-29-54(52)68-55-30-28-47(37-53(55)66)67-46-22-13-21-45(36-46)64-38-65(51-26-11-10-25-50(51)64)57-48(40-17-8-5-9-18-40)23-14-24-49(57)42-20-12-19-41(33-42)39-15-6-4-7-16-39;/h4-35,38H,1-3H3;/q-3;.
What are the key properties of 10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum?
10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum has a molecular weight of 1202.68 g/mol, XLogP of 14.64, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2-phenyl-6-(3-phenylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-8-(trifluoromethyl)-1H-phenotellurazin-1-ide;platinum is sourced from PubChem (CID 168840824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).