3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+))

C170H141N18Pt3-3 — CID 157105935

IUPAC3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+))
SMILESCC(C)(C)c1ccc2[n-]c3c(-c4nn(-c5[c-]c(N(c6ccccc6)c6cc(-c7ccccc7)ccn6)c6c(c5)c5ccccc5n6-c5ccccc5)c5ccccc45)cc(C(C)(C)C)cc3c2c1.CC(C)(C)c1ccc2[n-]c3c(-c4nn(-c5cccc6c5[c-]c(N(c5ccccc5)c5ccccn5)n6-c5ccccc5)c5ccccc45)cc(C(C)(C)C)cc3c2c1.CC(C)(C)c1ccc2[n-]c3c(C(=[N-])c4ccccc4Nc4[c-]c(N(c5ccccc5)c5ccccn5)c5c6ccccc6n(-c6ccccc6)c5c4)cc(C(C)(C)C)cc3c2c1.[Pt+2].[Pt+2].[Pt]
InChIInChI=1S/C62H50N6.C56H47N6.C52H44N6.3Pt/c1-61(2,3)42-30-31-53-49(35-42)50-36-43(62(4,5)6)37-52(58(50)64-53)59-48-27-17-19-29-55(48)68(65-59)46-38-51-47-26-16-18-28-54(47)67(45-24-14-9-15-25-45)60(51)56(39-46)66(44-22-12-8-13-23-44)57-34-41(32-33-63-57)40-20-10-7-11-21-40;1-55(2,3)36-28-29-47-43(31-36)44-32-37(56(4,5)6)33-45(54(44)60-47)53(57)41-23-13-15-25-46(41)59-38-34-49-52(42-24-14-16-26-48(42)61(49)39-19-9-7-10-20-39)50(35-38)62(40-21-11-8-12-22-40)51-27-17-18-30-58-51;1-51(2,3)34-27-28-43-39(30-34)40-31-35(52(4,5)6)32-42(49(40)54-43)50-38-22-13-14-23-45(38)58(55-50)46-25-17-24-44-41(46)33-48(56(44)36-18-9-7-10-19-36)57(37-20-11-8-12-21-37)47-26-15-16-29-53-47;;;/h7-38H,1-6H3;7-34,59H,1-6H3;7-32H,1-6H3;;;/q-2;-3;-2;;2*+2
InChIKeyRCNUYEIFEUBWHW-UHFFFAOYSA-N
MW3021.36 g/mol
LogP43.59
Rot. Bonds21

About 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+))

3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+)) (PubChem CID 157105935) has the molecular formula C170H141N18Pt3-3 and a molecular weight of 3021.36 g/mol. Its IUPAC name is 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+)).

Molecular Properties

Compound Name3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+))
PubChem CID157105935
Molecular FormulaC170H141N18Pt3-3
Molecular Weight3021.36 g/mol
Exact Mass3019.05
IUPAC Name3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+))
SMILESCC(C)(C)c1ccc2[n-]c3c(-c4nn(-c5[c-]c(N(c6ccccc6)c6cc(-c7ccccc7)ccn6)c6c(c5)c5ccccc5n6-c5ccccc5)c5ccccc45)cc(C(C)(C)C)cc3c2c1.CC(C)(C)c1ccc2[n-]c3c(-c4nn(-c5cccc6c5[c-]c(N(c5ccccc5)c5ccccn5)n6-c5ccccc5)c5ccccc45)cc(C(C)(C)C)cc3c2c1.CC(C)(C)c1ccc2[n-]c3c(C(=[N-])c4ccccc4Nc4[c-]c(N(c5ccccc5)c5ccccn5)c5c6ccccc6n(-c6ccccc6)c5c4)cc(C(C)(C)C)cc3c2c1.[Pt+2].[Pt+2].[Pt]
InChIInChI=1S/C62H50N6.C56H47N6.C52H44N6.3Pt/c1-61(2,3)42-30-31-53-49(35-42)50-36-43(62(4,5)6)37-52(58(50)64-53)59-48-27-17-19-29-55(48)68(65-59)46-38-51-47-26-16-18-28-54(47)67(45-24-14-9-15-25-45)60(51)56(39-46)66(44-22-12-8-13-23-44)57-34-41(32-33-63-57)40-20-10-7-11-21-40;1-55(2,3)36-28-29-47-43(31-36)44-32-37(56(4,5)6)33-45(54(44)60-47)53(57)41-23-13-15-25-46(41)59-38-34-49-52(42-24-14-16-26-48(42)61(49)39-19-9-7-10-20-39)50(35-38)62(40-21-11-8-12-22-40)51-27-17-18-30-58-51;1-51(2,3)34-27-28-43-39(30-34)40-31-35(52(4,5)6)32-42(49(40)54-43)50-38-22-13-14-23-45(38)58(55-50)46-25-17-24-44-41(46)33-48(56(44)36-18-9-7-10-19-36)57(37-20-11-8-12-21-37)47-26-15-16-29-53-47;;;/h7-38H,1-6H3;7-34,59H,1-6H3;7-32H,1-6H3;;;/q-2;-3;-2;;2*+2
InChIKeyRCNUYEIFEUBWHW-UHFFFAOYSA-N
XLogP43.59
TPSA175.45 Ų
H-Bond Donors1
H-Bond Acceptors14
Rotatable Bonds21
Heavy Atoms191
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003021.36
LogP ≤ 543.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+))?
The IUPAC name of 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+)) (CID 157105935) is 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+)).
What is the SMILES notation for 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+))?
The canonical SMILES for 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+)) is CC(C)(C)c1ccc2[n-]c3c(-c4nn(-c5[c-]c(N(c6ccccc6)c6cc(-c7ccccc7)ccn6)c6c(c5)c5ccccc5n6-c5ccccc5)c5ccccc45)cc(C(C)(C)C)cc3c2c1.CC(C)(C)c1ccc2[n-]c3c(-c4nn(-c5cccc6c5[c-]c(N(c5ccccc5)c5ccccn5)n6-c5ccccc5)c5ccccc45)cc(C(C)(C)C)cc3c2c1.CC(C)(C)c1ccc2[n-]c3c(C(=[N-])c4ccccc4Nc4[c-]c(N(c5ccccc5)c5ccccn5)c5c6ccccc6n(-c6ccccc6)c5c4)cc(C(C)(C)C)cc3c2c1.[Pt+2].[Pt+2].[Pt].
What is the InChIKey of 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+))?
The InChIKey is RCNUYEIFEUBWHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H50N6.C56H47N6.C52H44N6.3Pt/c1-61(2,3)42-30-31-53-49(35-42)50-36-43(62(4,5)6)37-52(58(50)64-53)59-48-27-17-19-29-55(48)68(65-59)46-38-51-47-26-16-18-28-54(47)67(45-24-14-9-15-25-45)60(51)56(39-46)66(44-22-12-8-13-23-44)57-34-41(32-33-63-57)40-20-10-7-11-21-40;1-55(2,3)36-28-29-47-43(31-36)44-32-37(56(4,5)6)33-45(54(44)60-47)53(57)41-23-13-15-25-46(41)59-38-34-49-52(42-24-14-16-26-48(42)61(49)39-19-9-7-10-20-39)50(35-38)62(40-21-11-8-12-22-40)51-27-17-18-30-58-51;1-51(2,3)34-27-28-43-39(30-34)40-31-35(52(4,5)6)32-42(49(40)54-43)50-38-22-13-14-23-45(38)58(55-50)46-25-17-24-44-41(46)33-48(56(44)36-18-9-7-10-19-36)57(37-20-11-8-12-21-37)47-26-15-16-29-53-47;;;/h7-38H,1-6H3;7-34,59H,1-6H3;7-32H,1-6H3;;;/q-2;-3;-2;;2*+2.
What are the key properties of 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+))?
3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+)) has a molecular weight of 3021.36 g/mol, XLogP of 43.59, 21 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,9-diphenyl-N-(4-phenyl-2-pyridinyl)-2H-carbazol-2-id-1-amine;4-[3-(3,6-ditert-butylcarbazol-9-id-1-yl)indazol-1-yl]-N,1-diphenyl-N-pyridin-2-yl-3H-indol-3-id-2-amine;[(3,6-ditert-butylcarbazol-9-id-1-yl)-[2-[[9-phenyl-4-(N-pyridin-2-ylanilino)-3H-carbazol-3-id-2-yl]amino]phenyl]methylidene]azanide;platinum;bis(platinum(2+)) is sourced from PubChem (CID 157105935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).