[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+))

C160H114B3N17Pt3S — CID 161148604

About [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+))

[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+)) (PubChem CID 161148604) has the molecular formula C160H114B3N17Pt3S and a molecular weight of 2924.53 g/mol. Its IUPAC name is [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+)).

Molecular Properties

• Compound Name: [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+))
• PubChem CID: 161148604
• Molecular Formula: C160H114B3N17Pt3S
• Molecular Weight: 2924.53 g/mol
• Exact Mass: 2922.84
• IUPAC Name: [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+))
• SMILES: CC(C)(C)c1ccnc(-n2c3[c-]c(B(c4[c-]c5c(cc4)c4ccccc4n5-c4ccccn4)c4c(-c5ccccc5)nn(-c5ccccc5)c4-c4ccccc4)ccc3c3ccccc32)c1.Cn1ccnc1-c1[c-]c(B(c2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)c2c(-c3ccccc3)nn(-c3ccccc3)c2-c2ccccc2)ccc1.[Pt+2].[Pt+2].[Pt+2].[c-]1c(B(c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)c2c(-c3ccccc3)nsc2-c2ccccc2)ccc2c3ccccc3n(-c3ccccn3)c12
• InChI: InChI=1S/C59H43BN6.C52H41BN6.C49H30BN5S.3Pt/c1-59(2,3)42-34-36-62-55(37-42)65-51-28-16-14-26-47(51)49-33-31-44(39-53(49)65)60(43-30-32-48-46-25-13-15-27-50(46)64(52(48)38-43)54-29-17-18-35-61-54)56-57(40-19-7-4-8-20-40)63-66(45-23-11-6-12-24-45)58(56)41-21-9-5-10-22-41;1-52(2,3)39-29-30-54-47(34-39)58-45-26-15-14-25-43(45)44-28-27-41(35-46(44)58)53(40-22-16-21-38(33-40)51-55-31-32-57(51)4)48-49(36-17-8-5-9-18-36)56-59(42-23-12-7-13-24-42)50(48)37-19-10-6-11-20-37;1-3-15-33(16-4-1)48-47(49(56-53-48)34-17-5-2-6-18-34)50(35-25-27-39-37-19-7-9-21-41(37)54(43(39)31-35)45-23-11-13-29-51-45)36-26-28-40-38-20-8-10-22-42(38)55(44(40)32-36)46-24-12-14-30-52-46;;;/h4-37H,1-3H3;5-32,34H,1-4H3;1-30H;;;/q3*-2;3*+2
• InChIKey: PKNVLXPJAOHTTJ-UHFFFAOYSA-N
• XLogP: 30.69
• TPSA: 155.45 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 23
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2924.53
LogP ≤ 5	30.69
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+))?

The IUPAC name of [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+)) (CID 161148604) is [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+)).

What is the SMILES notation for [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+))?

The canonical SMILES for [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+)) is CC(C)(C)c1ccnc(-n2c3[c-]c(B(c4[c-]c5c(cc4)c4ccccc4n5-c4ccccn4)c4c(-c5ccccc5)nn(-c5ccccc5)c4-c4ccccc4)ccc3c3ccccc32)c1.Cn1ccnc1-c1[c-]c(B(c2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)c2c(-c3ccccc3)nn(-c3ccccc3)c2-c2ccccc2)ccc1.[Pt+2].[Pt+2].[Pt+2].[c-]1c(B(c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)c2c(-c3ccccc3)nsc2-c2ccccc2)ccc2c3ccccc3n(-c3ccccn3)c12.

What is the InChIKey of [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+))?

The InChIKey is PKNVLXPJAOHTTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H43BN6.C52H41BN6.C49H30BN5S.3Pt/c1-59(2,3)42-34-36-62-55(37-42)65-51-28-16-14-26-47(51)49-33-31-44(39-53(49)65)60(43-30-32-48-46-25-13-15-27-50(46)64(52(48)38-43)54-29-17-18-35-61-54)56-57(40-19-7-4-8-20-40)63-66(45-23-11-6-12-24-45)58(56)41-21-9-5-10-22-41;1-52(2,3)39-29-30-54-47(34-39)58-45-26-15-14-25-43(45)44-28-27-41(35-46(44)58)53(40-22-16-21-38(33-40)51-55-31-32-57(51)4)48-49(36-17-8-5-9-18-36)56-59(42-23-12-7-13-24-42)50(48)37-19-10-6-11-20-37;1-3-15-33(16-4-1)48-47(49(56-53-48)34-17-5-2-6-18-34)50(35-25-27-39-37-19-7-9-21-41(37)54(43(39)31-35)45-23-11-13-29-51-45)36-26-28-40-38-20-8-10-22-42(38)55(44(40)32-36)46-24-12-14-30-52-46;;;/h4-37H,1-3H3;5-32,34H,1-4H3;1-30H;;;/q3*-2;3*+2.

What are the key properties of [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+))?

[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+)) has a molecular weight of 2924.53 g/mol, XLogP of 30.69, 23 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for [9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-(1,3,5-triphenylpyrazol-4-yl)borane;[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-(1,3,5-triphenylpyrazol-4-yl)borane;(3,5-diphenyl-1,2-thiazol-4-yl)-bis(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tris(platinum(2+)) is sourced from PubChem (CID 161148604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).