2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum

C164H147N14O6Pt5S6-5 — CID 158548358

About 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum

2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum (PubChem CID 158548358) has the molecular formula C164H147N14O6Pt5S6-5 and a molecular weight of 3577.86 g/mol. Its IUPAC name is 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum.

Molecular Properties

• Compound Name: 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum
• PubChem CID: 158548358
• Molecular Formula: C164H147N14O6Pt5S6-5
• Molecular Weight: 3577.86 g/mol
• Exact Mass: 3574.82
• IUPAC Name: 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum
• SMILES: CC(C)(C)c1cc(/C=N/c2ccccc2-c2nc3c(-c4[c-]ncc5ccccc45)cccc3s2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(/C=N/c2ccccc2-c2nc3c(-c4ccc[n-]4)cccc3s2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(/C=N/c2ccccc2-c2nc3c(-c4ccn[n-]4)cccc3s2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1ccc(O)c(/C=N/c2ccccc2-c2nc3c(-c4[c-]c5ccccc5o4)cccc3s2)c1.CC(C)(C)c1ccc(O)c(/C=N/c2ccccc2-c2nc3c(-c4[c-]c5ccccc5s4)cccc3s2)c1.[Pt].[Pt].[Pt].[Pt].[Pt]
• InChI: InChI=1S/C37H34N3OS.C32H32N3OS.C32H25N2O2S.C32H25N2OS2.C31H31N4OS.5Pt/c1-36(2,3)25-18-24(34(41)30(19-25)37(4,5)6)21-39-31-16-10-9-14-28(31)35-40-33-27(15-11-17-32(33)42-35)29-22-38-20-23-12-7-8-13-26(23)29;1-31(2,3)21-17-20(29(36)24(18-21)32(4,5)6)19-34-26-13-8-7-11-23(26)30-35-28-22(25-14-10-16-33-25)12-9-15-27(28)37-30;1-32(2,3)22-15-16-26(35)21(17-22)19-33-25-12-6-5-10-23(25)31-34-30-24(11-8-14-29(30)37-31)28-18-20-9-4-7-13-27(20)36-28;1-32(2,3)22-15-16-26(35)21(17-22)19-33-25-12-6-5-10-23(25)31-34-30-24(11-8-14-28(30)37-31)29-18-20-9-4-7-13-27(20)36-29;1-30(2,3)20-16-19(28(36)23(17-20)31(4,5)6)18-32-24-12-8-7-10-22(24)29-34-27-21(25-14-15-33-35-25)11-9-13-26(27)37-29;;;;;/h7-21,41H,1-6H3;7-19H,1-6H3,(H,34,35,36);2*4-17,19,35H,1-3H3;7-18H,1-6H3,(H-,32,33,34,35,36);;;;;/q5*-1;;;;;/b39-21+;;2*33-19+
• InChIKey: PBABJVQVMJUAEL-KNYZBYEOSA-N
• XLogP: 45.02
• TPSA: 294.52 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 24
• Rotatable Bonds: 20
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3577.86
LogP ≤ 5	45.02
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum?

The IUPAC name of 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum (CID 158548358) is 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum.

What is the SMILES notation for 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum?

The canonical SMILES for 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum is CC(C)(C)c1cc(/C=N/c2ccccc2-c2nc3c(-c4[c-]ncc5ccccc45)cccc3s2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(/C=N/c2ccccc2-c2nc3c(-c4ccc[n-]4)cccc3s2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(/C=N/c2ccccc2-c2nc3c(-c4ccn[n-]4)cccc3s2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1ccc(O)c(/C=N/c2ccccc2-c2nc3c(-c4[c-]c5ccccc5o4)cccc3s2)c1.CC(C)(C)c1ccc(O)c(/C=N/c2ccccc2-c2nc3c(-c4[c-]c5ccccc5s4)cccc3s2)c1.[Pt].[Pt].[Pt].[Pt].[Pt].

What is the InChIKey of 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum?

The InChIKey is PBABJVQVMJUAEL-KNYZBYEOSA-N. The full InChI is InChI=1S/C37H34N3OS.C32H32N3OS.C32H25N2O2S.C32H25N2OS2.C31H31N4OS.5Pt/c1-36(2,3)25-18-24(34(41)30(19-25)37(4,5)6)21-39-31-16-10-9-14-28(31)35-40-33-27(15-11-17-32(33)42-35)29-22-38-20-23-12-7-8-13-26(23)29;1-31(2,3)21-17-20(29(36)24(18-21)32(4,5)6)19-34-26-13-8-7-11-23(26)30-35-28-22(25-14-10-16-33-25)12-9-15-27(28)37-30;1-32(2,3)22-15-16-26(35)21(17-22)19-33-25-12-6-5-10-23(25)31-34-30-24(11-8-14-29(30)37-31)28-18-20-9-4-7-13-27(20)36-28;1-32(2,3)22-15-16-26(35)21(17-22)19-33-25-12-6-5-10-23(25)31-34-30-24(11-8-14-28(30)37-31)29-18-20-9-4-7-13-27(20)36-29;1-30(2,3)20-16-19(28(36)23(17-20)31(4,5)6)18-32-24-12-8-7-10-22(24)29-34-27-21(25-14-15-33-35-25)11-9-13-26(27)37-29;;;;;/h7-21,41H,1-6H3;7-19H,1-6H3,(H,34,35,36);2*4-17,19,35H,1-3H3;7-18H,1-6H3,(H-,32,33,34,35,36);;;;;/q5*-1;;;;;/b39-21+;;2*33-19+;;;;;;.

What are the key properties of 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum?

2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum has a molecular weight of 3577.86 g/mol, XLogP of 45.02, 20 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[2-[4-(3H-1-benzofuran-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2-[[2-[4-(3H-1-benzothiophen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]-4-tert-butylphenol;2,4-ditert-butyl-6-[[2-[4-(3H-isoquinolin-3-id-4-yl)-1,3-benzothiazol-2-yl]phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;2,4-ditert-butyl-6-[[2-(4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;platinum is sourced from PubChem (CID 158548358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).