6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+)

C98H60N6O3Pt — CID 59358678

IUPAC6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+)
SMILESCOc1c(-c2ccccc2)cc(C)cc1-c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-c5ccc6c(c5)c5ccc[c-]c5n5nccc65)cc4c3c2)cc1.[Pt+2].[c-]1cccc2c3cc(-c4ccc5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c5c4)ccc3c3ccnn3c12
InChIInChI=1S/C59H38N3O2.C39H22N3O.Pt/c1-36-30-47(38-10-4-3-5-11-38)59(63-2)48(31-36)39-18-16-37(17-19-39)40-21-25-54-50(33-40)45-13-6-8-14-53(45)61(54)43-23-27-58-52(35-43)51-34-42(22-26-57(51)64-58)41-20-24-46-49(32-41)44-12-7-9-15-55(44)62-56(46)28-29-60-62;1-4-10-34-27(7-1)28-8-2-5-11-35(28)41(34)26-15-18-39-33(23-26)32-22-25(14-17-38(32)43-39)24-13-16-30-31(21-24)29-9-3-6-12-36(29)42-37(30)19-20-40-42;/h3-14,16-35H,1-2H3;1-11,13-23H;/q2*-1;+2
InChIKeyLUFQCTYGBDZQBB-UHFFFAOYSA-N
MW1564.67 g/mol
LogP25.52
Rot. Bonds8

About 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+)

6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+) (PubChem CID 59358678) has the molecular formula C98H60N6O3Pt and a molecular weight of 1564.67 g/mol. Its IUPAC name is 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+).

Molecular Properties

Compound Name6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+)
PubChem CID59358678
Molecular FormulaC98H60N6O3Pt
Molecular Weight1564.67 g/mol
Exact Mass1563.44
IUPAC Name6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+)
SMILESCOc1c(-c2ccccc2)cc(C)cc1-c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-c5ccc6c(c5)c5ccc[c-]c5n5nccc65)cc4c3c2)cc1.[Pt+2].[c-]1cccc2c3cc(-c4ccc5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c5c4)ccc3c3ccnn3c12
InChIInChI=1S/C59H38N3O2.C39H22N3O.Pt/c1-36-30-47(38-10-4-3-5-11-38)59(63-2)48(31-36)39-18-16-37(17-19-39)40-21-25-54-50(33-40)45-13-6-8-14-53(45)61(54)43-23-27-58-52(35-43)51-34-42(22-26-57(51)64-58)41-20-24-46-49(32-41)44-12-7-9-15-55(44)62-56(46)28-29-60-62;1-4-10-34-27(7-1)28-8-2-5-11-35(28)41(34)26-15-18-39-33(23-26)32-22-25(14-17-38(32)43-39)24-13-16-30-31(21-24)29-9-3-6-12-36(29)42-37(30)19-20-40-42;/h3-14,16-35H,1-2H3;1-11,13-23H;/q2*-1;+2
InChIKeyLUFQCTYGBDZQBB-UHFFFAOYSA-N
XLogP25.52
TPSA79.97 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms108
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001564.67
LogP ≤ 525.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+)?
The IUPAC name of 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+) (CID 59358678) is 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+).
What is the SMILES notation for 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+)?
The canonical SMILES for 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+) is COc1c(-c2ccccc2)cc(C)cc1-c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-c5ccc6c(c5)c5ccc[c-]c5n5nccc65)cc4c3c2)cc1.[Pt+2].[c-]1cccc2c3cc(-c4ccc5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c5c4)ccc3c3ccnn3c12.
What is the InChIKey of 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+)?
The InChIKey is LUFQCTYGBDZQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H38N3O2.C39H22N3O.Pt/c1-36-30-47(38-10-4-3-5-11-38)59(63-2)48(31-36)39-18-16-37(17-19-39)40-21-25-54-50(33-40)45-13-6-8-14-53(45)61(54)43-23-27-58-52(35-43)51-34-42(22-26-57(51)64-58)41-20-24-46-49(32-41)44-12-7-9-15-55(44)62-56(46)28-29-60-62;1-4-10-34-27(7-1)28-8-2-5-11-35(28)41(34)26-15-18-39-33(23-26)32-22-25(14-17-38(32)43-39)24-13-16-30-31(21-24)29-9-3-6-12-36(29)42-37(30)19-20-40-42;/h3-14,16-35H,1-2H3;1-11,13-23H;/q2*-1;+2.
What are the key properties of 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+)?
6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+) has a molecular weight of 1564.67 g/mol, XLogP of 25.52, 8 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(8-carbazol-9-yldibenzofuran-2-yl)-11H-pyrazolo[1,5-f]phenanthridin-11-ide;6-[8-[3-[4-(2-methoxy-5-methyl-3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]-11H-pyrazolo[1,5-f]phenanthridin-11-ide;platinum(2+) is sourced from PubChem (CID 59358678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).