2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum

C168H172N8O4Pt4S4-4 — CID 157234655

About 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum

2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum (PubChem CID 157234655) has the molecular formula C168H172N8O4Pt4S4-4 and a molecular weight of 3275.86 g/mol. Its IUPAC name is 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum
• PubChem CID: 157234655
• Molecular Formula: C168H172N8O4Pt4S4-4
• Molecular Weight: 3275.86 g/mol
• Exact Mass: 3273.10
• IUPAC Name: 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum
• SMILES: CC(C)(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cc(C(C)(C)C)cc4sc(-c5ccccc5O)nc34)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cccc4sc(-c5ccccc5O)nc34)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc(-c3ccccn3)[c-]c(-c3cc(C(C)(C)C)cc4sc(-c5ccccc5O)nc34)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc(-c3ccccn3)[c-]c(-c3cccc4sc(-c5ccccc5O)nc34)c2)cc(C(C)(C)C)c1.[Pt].[Pt].[Pt].[Pt]
• InChI: InChI=1S/C46H51N2OS.2C42H43N2OS.C38H35N2OS.4Pt/c1-43(2,3)32-17-18-47-38(26-32)31-20-28(29-22-33(44(4,5)6)24-34(23-29)45(7,8)9)19-30(21-31)37-25-35(46(10,11)12)27-40-41(37)48-42(50-40)36-15-13-14-16-39(36)49;1-40(2,3)30-21-27(22-31(23-30)41(4,5)6)26-18-28(20-29(19-26)35-15-12-13-17-43-35)34-24-32(42(7,8)9)25-37-38(34)44-39(46-37)33-14-10-11-16-36(33)45;1-40(2,3)30-17-18-43-35(25-30)29-20-26(27-22-31(41(4,5)6)24-32(23-27)42(7,8)9)19-28(21-29)33-14-12-16-37-38(33)44-39(46-37)34-13-10-11-15-36(34)45;1-37(2,3)28-21-25(22-29(23-28)38(4,5)6)24-18-26(20-27(19-24)32-14-9-10-17-39-32)30-13-11-16-34-35(30)40-36(42-34)31-12-7-8-15-33(31)41;;;;/h13-20,22-27,49H,1-12H3;10-19,21-25,45H,1-9H3;10-20,22-25,45H,1-9H3;7-19,21-23,41H,1-6H3;;;;/q4*-1
• InChIKey: YPRRTWRQYCAYLY-UHFFFAOYSA-N
• XLogP: 47.02
• TPSA: 184.04 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 16
• Rotatable Bonds: 16
• Heavy Atoms: 188
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3275.86
LogP ≤ 5	47.02
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum?

The IUPAC name of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum (CID 157234655) is 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum.

What is the SMILES notation for 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum?

The canonical SMILES for 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum is CC(C)(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cc(C(C)(C)C)cc4sc(-c5ccccc5O)nc34)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cccc4sc(-c5ccccc5O)nc34)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc(-c3ccccn3)[c-]c(-c3cc(C(C)(C)C)cc4sc(-c5ccccc5O)nc34)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc(-c3ccccn3)[c-]c(-c3cccc4sc(-c5ccccc5O)nc34)c2)cc(C(C)(C)C)c1.[Pt].[Pt].[Pt].[Pt].

What is the InChIKey of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum?

The InChIKey is YPRRTWRQYCAYLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H51N2OS.2C42H43N2OS.C38H35N2OS.4Pt/c1-43(2,3)32-17-18-47-38(26-32)31-20-28(29-22-33(44(4,5)6)24-34(23-29)45(7,8)9)19-30(21-31)37-25-35(46(10,11)12)27-40-41(37)48-42(50-40)36-15-13-14-16-39(36)49;1-40(2,3)30-21-27(22-31(23-30)41(4,5)6)26-18-28(20-29(19-26)35-15-12-13-17-43-35)34-24-32(42(7,8)9)25-37-38(34)44-39(46-37)33-14-10-11-16-36(33)45;1-40(2,3)30-17-18-43-35(25-30)29-20-26(27-22-31(41(4,5)6)24-32(23-27)42(7,8)9)19-28(21-29)33-14-12-16-37-38(33)44-39(46-37)34-13-10-11-15-36(34)45;1-37(2,3)28-21-25(22-29(23-28)38(4,5)6)24-18-26(20-27(19-24)32-14-9-10-17-39-32)30-13-11-16-34-35(30)40-36(42-34)31-12-7-8-15-33(31)41;;;;/h13-20,22-27,49H,1-12H3;10-19,21-25,45H,1-9H3;10-20,22-25,45H,1-9H3;7-19,21-23,41H,1-6H3;;;;/q4*-1;;;;.

What are the key properties of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum?

2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum has a molecular weight of 3275.86 g/mol, XLogP of 47.02, 16 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-(3,5-ditert-butylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(3,5-ditert-butylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum is sourced from PubChem (CID 157234655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).