9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

C143H125N12O3Pt3-9 — CID 160761019

IUPAC9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
SMILESCC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5C=CN(c6ccc(-c7ccccc7)c(-c7ccccc7)c6)[CH-]5)ccc4)ccc3c3ccccc32)c1.CC(C)c1cc(C(C)C)c(-c2cccc(N3C=CN(c4[c-]c(Oc5[c-]c6c(cc5)c5ccccc5n6-c5cc(C(C)(C)C)ccn5)ccc4)[CH-]3)c2)c(C(C)C)c1.Cc1cccc(C)c1-c1cccc(N2C=CN(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)ccc3)[CH-]2)c1.[Pt].[Pt].[Pt]
InChIInChI=1S/C51H51N4O.C48H37N4O.C44H37N4O.3Pt/c1-33(2)37-27-45(34(3)4)50(46(28-37)35(5)6)36-14-12-15-39(26-36)53-24-25-54(32-53)40-16-13-17-41(30-40)56-42-20-21-44-43-18-10-11-19-47(43)55(48(44)31-42)49-29-38(22-23-52-49)51(7,8)9;1-48(2,3)36-25-26-49-47(29-36)52-45-20-11-10-19-42(45)43-24-22-40(32-46(43)52)53-39-18-12-17-37(30-39)50-27-28-51(33-50)38-21-23-41(34-13-6-4-7-14-34)44(31-38)35-15-8-5-9-16-35;1-30-11-8-12-31(2)43(30)32-13-9-14-34(25-32)46-23-24-47(29-46)35-15-10-16-36(27-35)49-37-19-20-39-38-17-6-7-18-40(38)48(41(39)28-37)42-26-33(21-22-45-42)44(3,4)5;;;/h10-29,32-35H,1-9H3;4-29,31,33H,1-3H3;6-26,29H,1-5H3;;;/q3*-3;;;
InChIKeyKSYCSZMRLMLASB-UHFFFAOYSA-N
MW2644.89 g/mol
LogP37.01
Rot. Bonds22

About 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (PubChem CID 160761019) has the molecular formula C143H125N12O3Pt3-9 and a molecular weight of 2644.89 g/mol. Its IUPAC name is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

Molecular Properties

Compound Name9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
PubChem CID160761019
Molecular FormulaC143H125N12O3Pt3-9
Molecular Weight2644.89 g/mol
Exact Mass2642.90
IUPAC Name9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
SMILESCC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5C=CN(c6ccc(-c7ccccc7)c(-c7ccccc7)c6)[CH-]5)ccc4)ccc3c3ccccc32)c1.CC(C)c1cc(C(C)C)c(-c2cccc(N3C=CN(c4[c-]c(Oc5[c-]c6c(cc5)c5ccccc5n6-c5cc(C(C)(C)C)ccn5)ccc4)[CH-]3)c2)c(C(C)C)c1.Cc1cccc(C)c1-c1cccc(N2C=CN(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)ccc3)[CH-]2)c1.[Pt].[Pt].[Pt]
InChIInChI=1S/C51H51N4O.C48H37N4O.C44H37N4O.3Pt/c1-33(2)37-27-45(34(3)4)50(46(28-37)35(5)6)36-14-12-15-39(26-36)53-24-25-54(32-53)40-16-13-17-41(30-40)56-42-20-21-44-43-18-10-11-19-47(43)55(48(44)31-42)49-29-38(22-23-52-49)51(7,8)9;1-48(2,3)36-25-26-49-47(29-36)52-45-20-11-10-19-42(45)43-24-22-40(32-46(43)52)53-39-18-12-17-37(30-39)50-27-28-51(33-50)38-21-23-41(34-13-6-4-7-14-34)44(31-38)35-15-8-5-9-16-35;1-30-11-8-12-31(2)43(30)32-13-9-14-34(25-32)46-23-24-47(29-46)35-15-10-16-36(27-35)49-37-19-20-39-38-17-6-7-18-40(38)48(41(39)28-37)42-26-33(21-22-45-42)44(3,4)5;;;/h10-29,32-35H,1-9H3;4-29,31,33H,1-3H3;6-26,29H,1-5H3;;;/q3*-3;;;
InChIKeyKSYCSZMRLMLASB-UHFFFAOYSA-N
XLogP37.01
TPSA100.59 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds22
Heavy Atoms161
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002644.89
LogP ≤ 537.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

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

Analyze 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?
The IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (CID 160761019) is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.
What is the SMILES notation for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?
The canonical SMILES for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5C=CN(c6ccc(-c7ccccc7)c(-c7ccccc7)c6)[CH-]5)ccc4)ccc3c3ccccc32)c1.CC(C)c1cc(C(C)C)c(-c2cccc(N3C=CN(c4[c-]c(Oc5[c-]c6c(cc5)c5ccccc5n6-c5cc(C(C)(C)C)ccn5)ccc4)[CH-]3)c2)c(C(C)C)c1.Cc1cccc(C)c1-c1cccc(N2C=CN(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)ccc3)[CH-]2)c1.[Pt].[Pt].[Pt].
What is the InChIKey of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?
The InChIKey is KSYCSZMRLMLASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H51N4O.C48H37N4O.C44H37N4O.3Pt/c1-33(2)37-27-45(34(3)4)50(46(28-37)35(5)6)36-14-12-15-39(26-36)53-24-25-54(32-53)40-16-13-17-41(30-40)56-42-20-21-44-43-18-10-11-19-47(43)55(48(44)31-42)49-29-38(22-23-52-49)51(7,8)9;1-48(2,3)36-25-26-49-47(29-36)52-45-20-11-10-19-42(45)43-24-22-40(32-46(43)52)53-39-18-12-17-37(30-39)50-27-28-51(33-50)38-21-23-41(34-13-6-4-7-14-34)44(31-38)35-15-8-5-9-16-35;1-30-11-8-12-31(2)43(30)32-13-9-14-34(25-32)46-23-24-47(29-46)35-15-10-16-36(27-35)49-37-19-20-39-38-17-6-7-18-40(38)48(41(39)28-37)42-26-33(21-22-45-42)44(3,4)5;;;/h10-29,32-35H,1-9H3;4-29,31,33H,1-3H3;6-26,29H,1-5H3;;;/q3*-3;;;.
What are the key properties of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?
9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum has a molecular weight of 2644.89 g/mol, XLogP of 37.01, 22 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-(2,6-dimethylphenyl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,4-diphenylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 160761019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).